data_6pts_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6pts _Structure_validation_residue.Date_analyzed 2020-05-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.429 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' B' ' 101' ' ' LYS . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . 0.461 ' HZ1' ' CD ' ' B' ' 98' ' ' GLU . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' D' ' 455' ' ' CYS . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . 0.439 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . 0.439 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . 0.414 ' CE1' ' SG ' ' D' ' 465' ' ' CYS . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' D' ' 439' ' ' HIS . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' D' ' 455' ' ' CYS . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . 0.491 ' CG ' ' HZ3' ' A' ' 264' ' ' LYS . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . 0.491 ' HZ3' ' CG ' ' A' ' 260' ' ' ASP . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . 0.504 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . 0.504 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . 0.443 ' CB ' ' SG ' ' D' ' 468' ' ' CYS . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . 0.443 ' SG ' ' CB ' ' D' ' 465' ' ' CYS . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . 0.424 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . 0.424 ' SG ' ' SG ' ' D' ' 455' ' ' CYS . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 483' ' ' MET . . . . . 0.419 ' C ' ' H ' ' D' ' 485' ' ' VAL . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' D' ' 483' ' ' MET . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . 0.486 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HZ1' ' CD ' ' A' ' 326' ' ' GLU . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . 0.431 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . 0.431 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.404 ' CD ' HH22 ' B' ' 68' ' ' ARG . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.404 HH22 ' CD ' ' B' ' 62' ' ' GLU . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.412 ' CD ' ' HZ1' ' B' ' 101' ' ' LYS . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' B' ' 98' ' ' GLU . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' D' ' 414' ' ' TRP . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . 0.422 ' H ' ' CG ' ' D' ' 413' ' ' ASP . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . 0.426 ' CB ' ' HH ' ' C' ' 521' ' ' TYR . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . 0.481 ' CD ' ' HZ3' ' C' ' 449' ' ' LYS . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . 0.481 ' HZ3' ' CD ' ' C' ' 446' ' ' GLU . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . 0.451 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . 0.451 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . 0.426 ' HH ' ' CB ' ' A' ' 250' ' ' VAL . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . 0.436 ' HG ' ' C ' ' B' ' 144' ' ' THR . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' THR . . . . . 0.436 ' C ' ' HG ' ' B' ' 118' ' ' CYS . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . 0.419 ' CG ' ' HZ1' ' A' ' 264' ' ' LYS . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . 0.419 ' HZ1' ' CG ' ' A' ' 260' ' ' ASP . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . 0.412 ' C ' ' H ' ' C' ' 495' ' ' LYS . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . 0.412 ' H ' ' C ' ' C' ' 493' ' ' GLN . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt . . . . . 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . 0.407 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . 0.407 ' SG ' ' SG ' ' D' ' 455' ' ' CYS . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' D' ' 387' ' ' LYS . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' THR . . . . . 0.497 ' H ' ' HG1' ' B' ' 35' ' ' THR . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . 0.445 ' HZ3' ' CD ' ' B' ' 31' ' ' GLU . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . 0.418 ' C ' ' HG ' ' B' ' 106' ' ' SER . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' SER . . . . . 0.418 ' HG ' ' C ' ' B' ' 105' ' ' ASP . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt . . . . . 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . 0.402 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . 0.402 ' SG ' ' SG ' ' D' ' 455' ' ' CYS . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 242' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' C' ' 532' ' ' ARG . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 458' ' ' ASP . . . . . 0.487 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 462' ' ' LYS . . . . . 0.487 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 532' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 242' ' ' GLU . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLU . . . . . 0.41 ' CD ' HH22 ' B' ' 68' ' ' ARG . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.41 HH22 ' CD ' ' B' ' 62' ' ' GLU . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.429 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.461 ' CD ' ' HZ1' ' B' ' 101' ' ' LYS . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . 0.461 ' HZ1' ' CD ' ' B' ' 98' ' ' GLU . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . 0.443 ' OD1' ' N1 ' ' D' ' 513' ' ' 17F . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . 0.51 ' HZ2' ' C3 ' ' A' ' 409' ' ' 17F . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -93.58 -46.98 7.04 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -81.85 -48.2 11.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.811 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 74.73 32.53 57.11 Favored Glycine 0 C--O 1.238 0.387 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.398 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 22.1 tptt 58.35 28.74 17.17 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.291 0.567 . . . . 10.0 111.579 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 24.7 tptp -81.38 -50.9 8.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.726 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? 73.28 -69.86 0.18 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.812 0.695 . . . . 10.0 112.178 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -135.83 163.65 29.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 10.0 111.126 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -100.71 -89.39 0.34 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.202 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -135.47 145.45 47.17 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.935 0.397 . . . . 10.0 110.185 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.1 m -118.36 141.87 48.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.14 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttm -146.29 139.96 26.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.68 0.276 . . . . 10.0 110.646 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 12.5 t -98.49 174.28 6.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.62 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -69.7 138.74 53.16 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.037 -0.357 . . . . 10.0 110.037 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 65.7 m . . . . . 0 C--O 1.236 0.352 0 O-C-N 123.397 0.436 . . . . 10.0 111.673 -179.888 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . 0.494 ' NZ ' ' O31' ' D' ' 503' ' ' PCW . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.527 ' C31' ' O3 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.51 ' C21' ' C17' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.568 ' C6 ' ' O4P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.81 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.549 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.629 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.544 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.519 ' O9 ' ' O8 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.436 ' O3 ' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.508 ' C1 ' ' C37' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.613 ' C41' ' C37' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.531 ' O3 ' ' O31' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.609 ' C20' ' C24' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.561 ' C12' ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.633 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.648 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.58 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.546 ' C31' ' C5 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.593 ' C3 ' ' P ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.651 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.616 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.506 ' O1P' ' C24' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.508 ' O31' ' C11' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.593 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.537 ' C32' ' C35' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.7 ' C21' ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.619 ' O31' ' C1 ' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.662 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.49 ' C7 ' ' C12' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.501 ' C23' ' C42' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.651 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.473 ' C14' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.448 ' C39' ' C43' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.599 ' O1P' ' C5 ' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.599 ' C5 ' ' O1P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.456 ' C17' ' C1Y' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.711 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.582 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.65 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.43 ' C2 ' ' C4 ' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.6 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.712 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.456 ' C1Y' ' C17' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.603 ' O7 ' ' C17' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.561 ' C9 ' ' C12' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.561 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.609 ' C6 ' ' O10' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.568 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.642 ' O1P' ' C3 ' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.53 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.592 ' C41' ' C8 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.5 ' O3 ' ' O31' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.487 ' P ' ' C3 ' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.425 ' O3 ' ' O31' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.646 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.527 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.485 ' C32' ' C4 ' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.663 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.638 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.419 ' O10' ' C12' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.597 ' N1 ' ' O2P' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.504 ' O7 ' ' C17' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.521 ' O31' ' C11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.494 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.656 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.658 ' C31' ' C35' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.665 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.692 ' C3 ' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.557 ' C33' ' C8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.845 ' C22' ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.455 ' O2 ' ' O11' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.627 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.708 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.54 ' C12' ' C24' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.557 ' C8 ' ' C33' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.643 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.486 ' C33' ' C22' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.496 ' O31' ' C1 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . 0.439 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . 0.439 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . 0.447 ' NH2' ' C2 ' ' B' ' 209' ' ' PCW . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -110.95 11.44 22.22 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -101.04 -69.31 0.78 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.447 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 68.39 23.57 75.04 Favored Glycine 0 C--N 1.331 0.262 0 CA-C-N 116.034 -0.53 . . . . 10.0 113.56 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 67.37 56.32 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.371 0.605 . . . . 10.0 110.929 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.7 136.27 38.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.229 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -92.08 128.93 38.1 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 159.62 30.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.03 0.443 . . . . 10.0 111.07 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 3.2 tptm -133.45 99.18 4.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.73 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -147.25 126.71 13.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.594 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 24.3 m -151.22 136.14 17.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.616 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -136.51 130.47 32.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.824 -0.436 . . . . 10.0 109.824 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -106.54 -66.95 0.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.704 -0.225 . . . . 10.0 111.008 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt 57.63 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 122.91 0.484 . . . . 10.0 112.119 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 63.0 m . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.605 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . 0.641 ' HZ1' ' C3 ' ' D' ' 514' ' ' 17F . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.602 ' C6 ' ' O31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.44 ' O11' ' C2 ' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.709 ' C16' ' C21' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.563 ' C6 ' ' O4P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.782 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.546 ' C11' ' O31' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.629 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.607 ' C17' ' O2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.452 ' O5 ' ' C8 ' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.47 ' C1 ' ' C3 ' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.55 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.682 ' C35' ' C13' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.591 ' C8 ' ' O31' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.556 ' C37' ' C43' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.505 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.641 ' C6 ' ' O4P' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.662 ' C43' ' C47' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.607 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.507 ' O4P' ' O1 ' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.694 ' C11' ' C31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.669 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.594 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.477 ' C2 ' ' O11' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.477 ' O4P' ' C8 ' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.647 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.538 ' C11' ' O31' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.682 ' C13' ' C35' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.584 ' C5 ' ' O1P' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.705 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.493 ' C5 ' ' O4 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.504 ' C45' ' C45' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.646 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.438 ' O3P' ' O31' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.482 ' O4P' ' C8 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.448 ' C41' ' C37' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.599 ' O3P' ' O31' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.452 ' C14' ' C1Z' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.72 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.598 ' C15' ' C19' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.633 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.649 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.697 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.507 ' O1 ' ' O4P' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.554 ' O7 ' ' C17' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.706 ' C32' ' C36' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.478 ' O10' ' C20' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.493 ' O4 ' ' C5 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.554 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.59 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.587 ' C34' ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.546 ' O3 ' ' O31' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.558 ' O3 ' ' O31' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.519 ' C3 ' ' O1P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.418 ' C27' ' C22' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.661 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.447 ' C2 ' ' NH2' ' B' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.482 ' O3 ' ' C31' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.653 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.653 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.51 ' O7 ' ' O10' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.486 ' C5 ' ' O8 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.583 ' C8 ' ' C38' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.739 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . 0.739 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.508 ' C6 ' ' O2P' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.471 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.61 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.664 ' C22' ' C26' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.626 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.689 ' C46' ' C42' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.492 ' C41' ' C37' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.602 ' O31' ' C6 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.515 ' O2 ' ' O11' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.614 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.696 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.523 ' C2 ' ' O2 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.641 ' C3 ' ' HZ1' ' D' ' 444' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.47 ' C3 ' ' C1 ' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.547 ' O31' ' C1 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . 0.491 ' CG ' ' HZ3' ' A' ' 264' ' ' LYS . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . 0.491 ' HZ3' ' CG ' ' A' ' 260' ' ' ASP . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . 0.504 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . 0.504 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 40.8 m170 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.461 ' HZ1' ' PG ' ' B' ' 216' ' ' GNP . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -80.09 -7.2 58.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -103.66 -46.79 4.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.352 . . . . 10.0 110.424 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.68 -75.29 2.15 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.909 -0.662 . . . . 10.0 112.175 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -169.46 52.43 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.1 0.476 . . . . 10.0 110.27 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -98.05 97.98 9.37 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.621 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -107.43 83.45 1.81 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.923 0.392 . . . . 10.0 111.348 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -165.56 113.02 0.95 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.027 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -121.23 125.35 46.9 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.243 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -116.05 103.29 10.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.642 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 14.2 t -100.38 135.02 42.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 10.0 110.736 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -86.82 -39.56 15.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.317 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.45 131.81 26.76 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.13 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -87.85 -39.88 14.46 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.237 0.418 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.87 179.535 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.553 ' O31' ' O3P' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.507 ' C8 ' ' O5 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.68 ' C16' ' C21' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.59 ' C35' ' C16' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.734 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.445 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.59 ' C16' ' C35' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.633 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.644 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.458 ' O6 ' ' O10' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.569 ' O3P' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.52 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.572 ' C33' ' C13' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.453 ' O3 ' ' O31' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.439 ' C31' ' O3 ' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.552 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.663 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.682 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.597 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.528 ' C6 ' ' P ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.581 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.706 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.612 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.506 ' C2 ' ' O11' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.486 ' C7 ' ' O11' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.656 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.477 ' C6 ' ' C32' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.572 ' C13' ' C33' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.553 ' O31' ' C1 ' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.615 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.51 ' C5 ' ' O5 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.574 ' C39' ' C14' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.644 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.574 ' C14' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.482 ' C39' ' C14' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.486 ' O11' ' C7 ' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.506 ' O11' ' O2 ' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.59 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.753 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.597 ' C15' ' C19' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.634 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.59 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.612 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.581 ' C7 ' ' C18' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.548 ' O10' ' O7 ' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.545 ' C9 ' ' C12' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.583 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.51 ' O5 ' ' C5 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.623 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.59 ' O1P' ' C3 ' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.565 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.524 ' O3 ' ' O31' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.516 ' C7 ' ' O1 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.67 ' C3 ' ' O2P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.469 ' O1P' ' C3 ' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.662 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.512 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.473 ' P ' ' O2 ' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.676 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.656 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.516 ' O1 ' ' C7 ' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.494 ' C5 ' ' O8 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.517 ' O10' ' O7 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.742 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . 0.742 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.429 ' C7 ' ' C19' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.57 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.663 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.545 ' C22' ' C18' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.601 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.668 ' C3 ' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.443 ' O11' ' C2 ' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.609 ' C3 ' ' O1P' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.538 ' O31' ' O3P' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.665 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.656 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.635 ' C17' ' C7 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.661 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.528 ' P ' ' C6 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.401 ' N ' ' O1B' ' B' ' 216' ' ' GNP . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' THR . . . . . 0.426 ' HG1' ' PG ' ' B' ' 216' ' ' GNP . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -71.63 -35.65 70.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -81.23 -52.72 7.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.065 0.459 . . . . 10.0 110.998 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 78.52 -108.09 2.59 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 110.827 -0.909 . . . . 10.0 110.827 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -136.06 22.96 3.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.184 0.516 . . . . 10.0 109.626 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -108.18 -120.7 0.25 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.476 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 2.8 ptmm? -159.54 89.93 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.07 0.462 . . . . 10.0 111.547 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -112.73 -3.59 14.21 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.003 -0.74 . . . . 10.0 109.003 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 17.5 pttt -92.96 101.11 13.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.9 -1.046 . . . . 10.0 110.606 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -151.3 33.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.226 0.536 . . . . 10.0 110.885 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 3.6 m -84.01 56.73 3.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.639 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -154.21 93.97 1.67 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.579 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 9.8 t -141.14 -40.27 0.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.541 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -169.68 81.16 0.12 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.145 0.498 . . . . 10.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.465 179.387 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 483' ' ' MET . . . . . 0.419 ' C ' ' H ' ' D' ' 485' ' ' VAL . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . 0.419 ' H ' ' C ' ' D' ' 483' ' ' MET . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.585 ' C6 ' ' O31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.452 ' O11' ' C2 ' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.541 ' C16' ' C21' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.586 ' C35' ' C15' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.828 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.435 ' C31' ' O3 ' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.586 ' C15' ' C35' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.621 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.626 ' C17' ' O2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.534 ' O9 ' ' O8 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.427 ' C45' ' C24' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.578 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.532 ' C36' ' C15' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.538 ' O3P' ' O31' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.514 ' C37' ' C43' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.553 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.69 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.64 ' C43' ' C47' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.583 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.63 ' O2 ' ' O1P' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.533 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.744 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.629 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.571 ' O1P' ' C22' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.568 ' C7 ' ' O11' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.624 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.532 ' C22' ' C44' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.803 ' C21' ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.485 ' C3 ' ' O31' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.678 ' C5 ' ' O1P' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.457 ' C6 ' ' O31' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.593 ' C39' ' C14' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.628 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.593 ' C14' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.532 ' C44' ' C22' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.568 ' O11' ' C7 ' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.563 ' O3P' ' O31' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.565 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.66 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.678 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.667 ' C24' ' C20' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.565 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.651 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.698 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.565 ' C9 ' ' C18' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.547 ' O6 ' ' O10' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.587 ' O8 ' ' C4 ' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.513 ' C6 ' ' O10' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.571 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.64 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.622 ' C21' ' O31' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.483 ' C11' ' C15' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.488 ' C14' ' C20' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.505 ' C41' ' C37' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.477 ' O3 ' ' O31' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.653 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.502 ' O3 ' ' C32' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.579 ' C22' ' C24' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.633 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.628 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.514 ' O7 ' ' O10' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.516 ' O10' ' C7 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.604 ' O10' ' P1 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.426 ' PG ' ' HG1' ' B' ' 35' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.537 ' O31' ' O3 ' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.545 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.655 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.752 ' O31' ' C35' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.608 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.672 ' C3 ' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.547 ' C12' ' O8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.593 ' C3 ' ' O1P' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.531 ' O2 ' ' O11' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.663 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.698 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.547 ' O8 ' ' C12' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.664 ' HN1' ' C4 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.451 ' C43' ' C46' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.553 ' O31' ' C1 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . 0.486 ' CD ' ' HZ1' ' C' ' 451' ' ' LYS . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . 0.486 ' HZ1' ' CD ' ' A' ' 326' ' ' GLU . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . 0.431 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . 0.431 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.401 ' N ' ' O1B' ' B' ' 216' ' ' GNP . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' THR . . . . . 0.401 ' HG1' ' PG ' ' B' ' 216' ' ' GNP . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.404 ' CD ' HH22 ' B' ' 68' ' ' ARG . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.404 HH22 ' CD ' ' B' ' 62' ' ' GLU . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.412 ' CD ' ' HZ1' ' B' ' 101' ' ' LYS . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . 0.412 ' HZ1' ' CD ' ' B' ' 98' ' ' GLU . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . 0.422 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -83.23 -33.42 26.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.22 -49.22 62.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.605 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 63.53 -101.53 0.46 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.632 -0.587 . . . . 10.0 111.632 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 33.2 mttp -134.06 14.22 3.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.935 0.398 . . . . 10.0 110.648 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.34 112.04 22.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.785 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -141.41 167.78 21.35 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? 73.26 119.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.284 0.564 . . . . 10.0 111.714 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -100.2 111.61 23.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.943 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . 0.436 ' NZ ' ' O4 ' ' A' ' 410' ' ' 17F . 20.3 tptp -90.15 92.2 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.215 0.531 . . . . 10.0 110.88 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' SER . . . . . 0.511 ' HG ' ' C31' ' D' ' 502' ' ' PCW . 11.1 m -136.85 142.01 42.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.9 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . 0.423 ' NZ ' HN1A ' A' ' 410' ' ' 17F . 37.6 mtmm -88.49 -28.69 20.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.588 0.218 . . . . 10.0 111.588 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 25.4 m 72.75 118.81 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.706 0.629 . . . . 10.0 111.314 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 63.79 74.49 0.41 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.7 0.762 . . . . 10.0 110.851 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.066 -0.97 . . . . 10.0 110.447 -179.151 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' D' ' 414' ' ' TRP . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . 0.422 ' H ' ' CG ' ' D' ' 413' ' ' ASP . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.586 ' O31' ' O3 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.469 ' O4P' ' C8 ' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.604 ' C16' ' C21' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.71 ' C3 ' ' O1P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.761 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.436 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.555 ' C11' ' O31' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.636 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.445 ' O10' ' C4 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.531 ' O1 ' ' C8 ' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.482 ' O3 ' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.592 ' O3 ' ' C41' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.623 ' O3P' ' O31' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.483 ' C6 ' ' C31' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.511 ' C31' ' O3 ' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.59 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.637 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.602 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.605 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.612 ' C4 ' ' C2 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.564 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.637 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.628 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.542 ' C7 ' ' C33' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.56 ' O31' ' O3 ' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.627 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.494 ' O3 ' ' O31' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.514 ' O2 ' ' C34' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.539 ' O11' ' C2 ' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.662 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.556 ' C5 ' ' O4 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.437 ' C39' ' C16' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.619 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.54 ' O3P' ' O31' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.409 ' O4P' ' C8 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.541 ' C2 ' ' C4 ' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.499 ' C19' ' C17' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.582 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.568 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.634 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.643 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.582 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.64 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.724 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.454 ' O7 ' ' O10' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.601 ' O7 ' ' C17' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.498 ' O10' ' O7 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.499 ' C17' ' C19' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.556 ' O4 ' ' C5 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.684 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.668 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.619 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.564 ' O3 ' ' O31' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.647 ' C24' ' C28' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.8 ' C23' ' C28' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.518 ' O3 ' ' O31' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.661 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.505 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.467 ' C32' ' C4 ' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.62 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.65 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.575 ' O7 ' ' O10' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.493 ' C6 ' ' C14' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.422 ' O6 ' ' N ' ' B' ' 146' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.522 ' C7 ' ' O31' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.531 ' C8 ' ' O1 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.67 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.763 ' C22' ' C18' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.584 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.646 ' C46' ' C42' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.498 ' O31' ' O3P' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.622 ' C3 ' ' O1P' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.551 ' O31' ' O3P' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.633 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.67 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.451 ' O9 ' ' C6 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.453 ' O7 ' ' C17' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.616 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.463 ' C35' ' C22' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.584 ' O31' ' C1 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . 0.426 ' CB ' ' HH ' ' C' ' 521' ' ' TYR . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . 0.481 ' CD ' ' HZ3' ' C' ' 449' ' ' LYS . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . 0.481 ' HZ3' ' CD ' ' C' ' 446' ' ' GLU . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . 0.451 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . 0.451 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . 0.426 ' HH ' ' CB ' ' A' ' 250' ' ' VAL . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . 0.449 ' N ' ' O2B' ' B' ' 216' ' ' GNP . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.428 ' NZ ' ' O3G' ' B' ' 216' ' ' GNP . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . 0.412 ' ND2' ' N7 ' ' B' ' 216' ' ' GNP . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . 0.436 ' HG ' ' C ' ' B' ' 144' ' ' THR . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' THR . . . . . 0.436 ' C ' ' HG ' ' B' ' 118' ' ' CYS . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . 0.452 ' NZ ' ' O4 ' ' B' ' 213' ' ' 17F . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -113.05 -48.48 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.01 -39.39 75.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.758 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 82.14 -83.07 1.57 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 110.994 -0.843 . . . . 10.0 110.994 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 1.4 tppm? -161.45 43.42 0.16 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.641 0.734 . . . . 10.0 109.544 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -102.84 84.8 2.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.287 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 2.7 mmpm? -84.06 61.44 6.47 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.585 0.707 . . . . 10.0 111.235 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -111.75 80.2 1.3 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.459 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -86.44 105.68 16.93 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.43 -0.805 . . . . 10.0 110.4 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -153.47 96.09 1.99 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.458 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 26.8 p -151.49 -106.96 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.921 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 24.1 tttm -158.66 105.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.799 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -50.64 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.076 0.465 . . . . 10.0 111.22 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -158.95 -55.64 0.06 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.082 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.238 0.487 0 O-C-N 123.834 0.709 . . . . 10.0 110.819 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.522 ' C5 ' ' O2P' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.527 ' O2 ' ' O1P' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.56 ' C21' ' C17' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.563 ' C6 ' ' O4P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.811 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.442 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.53 ' C11' ' O31' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.641 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.47 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.621 ' O5 ' ' C5 ' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.482 ' O3 ' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.584 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.541 ' C42' ' C23' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.534 ' C40' ' C44' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.494 ' C31' ' O3 ' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.525 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.621 ' C6 ' ' O4P' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.646 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.609 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.56 ' C22' ' C35' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.536 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.66 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.684 ' C21' ' C17' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.492 ' C2 ' ' O11' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.45 ' O31' ' C11' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.639 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.612 ' O2P' ' C6 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.65 ' C21' ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.535 ' C5 ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.706 ' C5 ' ' O1P' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.496 ' C11' ' O2 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.512 ' O3 ' ' C31' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.641 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.496 ' C14' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.612 ' C6 ' ' O2P' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.529 ' O31' ' O3P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.527 ' C14' ' C18' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.469 ' C24' ' C24' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.722 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.706 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.613 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.539 ' C22' ' C18' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.648 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.702 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.487 ' O7 ' ' O10' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.51 ' C9 ' ' C18' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.559 ' O6 ' ' O10' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.608 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.478 ' C6 ' ' O10' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.523 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.796 ' C31' ' C36' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.569 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.594 ' C12' ' C34' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.527 ' C6 ' ' O1 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.725 ' C3 ' ' O1P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.558 ' C6 ' ' O4 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.69 ' C43' ' C47' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.534 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.584 ' O2 ' ' O1P' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.734 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.635 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.558 ' O4 ' ' C6 ' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.488 ' C5 ' ' O8 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.569 ' O6 ' ' O10' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.449 ' O2B' ' N ' ' B' ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.539 ' O31' ' C11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.621 ' C5 ' ' O5 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.647 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.642 ' O31' ' O3 ' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.64 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.669 ' C3 ' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.42 ' O11' ' C2 ' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.564 ' C4 ' ' C3 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.624 ' C5 ' ' C1 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.662 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.523 ' O7 ' ' O10' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.601 ' N1 ' ' O1P' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.629 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.56 ' C35' ' C22' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.522 ' O11' ' O2 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . 0.419 ' CG ' ' HZ1' ' A' ' 264' ' ' LYS . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . 0.419 ' HZ1' ' CG ' ' A' ' 260' ' ' ASP . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . 0.412 ' C ' ' H ' ' C' ' 495' ' ' LYS . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . 0.412 ' H ' ' C ' ' C' ' 493' ' ' GLN . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' SER . . . . . 0.425 ' OG ' ' O2G' ' B' ' 216' ' ' GNP . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . 0.423 ' HZ2' ' C8 ' ' B' ' 207' ' ' PCW . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -95.32 -27.98 15.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.19 -50.37 6.03 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.749 0.309 . . . . 10.0 110.655 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.6 -136.94 26.65 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.699 -0.682 . . . . 10.0 113.104 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -124.03 41.53 3.47 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.453 0.644 . . . . 10.0 109.699 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 23.0 mtmt -127.96 105.74 8.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.297 -0.865 . . . . 10.0 109.282 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 135.16 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.909 0.385 . . . . 10.0 111.459 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 4.7 pttm -135.22 -79.39 0.44 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.884 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.41 -163.55 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 O-C-N 123.454 0.471 . . . . 10.0 111.7 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -144.3 151.36 39.27 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.714 -0.847 . . . . 10.0 108.714 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 42.9 m -147.05 113.36 5.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.352 0.12 . . . . 10.0 110.998 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? 72.94 107.43 0.07 Allowed 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.78 0.675 . . . . 10.0 111.446 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 15.1 t -140.14 138.23 35.06 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.771 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -158.29 101.72 1.73 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.172 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 40.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.985 179.218 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.595 ' C5 ' ' O31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.429 ' C31' ' O1P' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.587 ' O31' ' C4 ' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.585 ' C24' ' C22' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.825 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.412 ' C16' ' C35' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.626 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.588 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.541 ' O6 ' ' O10' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.444 ' C7 ' ' O4 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.545 ' C1 ' ' C37' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.587 ' C35' ' C13' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.515 ' O3 ' ' O31' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.481 ' C37' ' C41' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.544 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.637 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.652 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.59 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.62 ' O11' ' C6 ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.67 ' C11' ' C31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.566 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.591 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.512 ' C6 ' ' C28' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.543 ' O11' ' C8 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.592 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.546 ' C32' ' C35' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.664 ' C21' ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.484 ' O31' ' C1 ' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.693 ' C5 ' ' O1P' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.543 ' C8 ' ' O11' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.638 ' C3 ' ' P ' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.619 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.565 ' C16' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.541 ' O11' ' C3 ' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.411 ' O1P' ' C5 ' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.601 ' C14' ' C18' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.58 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.729 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.693 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.718 ' C27' ' C22' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.602 ' C2 ' ' C4 ' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.638 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.746 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.462 ' O9 ' ' O1 ' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.59 ' O10' ' O7 ' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.444 ' O4 ' ' C7 ' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.603 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.532 ' O10' ' C4 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.589 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.592 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.581 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.541 ' O3 ' ' O31' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.495 ' O3 ' ' O31' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.475 ' O2 ' ' O11' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.423 ' C8 ' ' HZ2' ' B' ' 165' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.647 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.479 ' O31' ' C8 ' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.585 ' C22' ' C24' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.631 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.634 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.462 ' O10' ' C7 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.565 ' O10' ' O7 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.763 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . 0.763 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.53 ' O31' ' C11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.523 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.644 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.551 ' O31' ' O3 ' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.638 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.675 ' C46' ' C42' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.406 ' C33' ' O8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.595 ' O31' ' C5 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.606 ' O31' ' O3P' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.679 ' C4 ' ' O31' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.657 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.477 ' O2 ' ' C2 ' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.529 ' O7 ' ' C17' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.629 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.548 ' C35' ' C24' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.52 ' O31' ' C1 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . 0.445 ' CD ' ' HZ3' ' D' ' 387' ' ' LYS . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' THR . . . . . 0.497 ' H ' ' HG1' ' B' ' 35' ' ' THR . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -93.25 -41.85 9.66 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -78.57 -55.75 4.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.352 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 95.97 27.46 10.24 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.841 -0.695 . . . . 10.0 112.225 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm 62.78 48.81 3.97 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -88.4 -49.64 6.81 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.888 -0.325 . . . . 10.0 110.719 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? 56.61 62.2 2.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.86 -0.609 . . . . 10.0 111.44 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -79.85 62.89 4.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.198 0.523 . . . . 10.0 110.745 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -97.74 -35.93 10.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.844 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -69.77 -42.21 74.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.047 0.451 . . . . 10.0 110.707 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.01 110.38 18.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.246 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -92.83 12.76 22.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.378 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.28 136.18 54.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.431 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -60.17 122.45 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 10.0 110.773 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.181 -179.928 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . 0.445 ' HZ3' ' CD ' ' B' ' 31' ' ' GLU . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.594 ' C7 ' ' O31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.502 ' C36' ' C44' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.614 ' C16' ' C21' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.639 ' C24' ' C22' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.807 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.48 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.523 ' C11' ' O31' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.641 ' C18' ' C14' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.529 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.436 ' C40' ' C47' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.514 ' C41' ' C37' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.63 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.458 ' C41' ' C37' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.437 ' C28' ' C27' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.421 ' C31' ' O3 ' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.523 ' O1P' ' C8 ' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.608 ' C6 ' ' O4P' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.62 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.582 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.538 ' C6 ' ' P ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.615 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.747 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.595 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.535 ' O3P' ' O31' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.594 ' O31' ' C11' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.592 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.511 ' O3 ' ' O31' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.515 ' O11' ' C2 ' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.641 ' C5 ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.649 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.491 ' C7 ' ' C13' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.565 ' C3 ' ' P ' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.648 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.512 ' C14' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.469 ' O31' ' C1 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.513 ' O31' ' O3P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.706 ' C3 ' ' O1P' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.559 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.696 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.598 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.618 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.559 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.668 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.711 ' C7 ' ' C18' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.498 ' O7 ' ' O10' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.559 ' O7 ' ' C17' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.523 ' O6 ' ' O10' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.472 ' C18' ' C11' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.569 ' O8 ' ' C5 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.587 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.764 ' C31' ' C36' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.65 ' C21' ' C32' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.566 ' C19' ' C23' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.506 ' C6 ' ' O2P' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.66 ' C3 ' ' O1P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.4 ' O3 ' ' O31' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.654 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.478 ' C35' ' C5 ' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.639 ' C22' ' C24' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.604 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.628 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.5 ' O7 ' ' O10' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.556 ' O10' ' C7 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.527 ' O10' ' O7 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.513 ' C2 ' ' O11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.702 ' C21' ' C17' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.688 ' C3 ' ' O1P' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.727 ' O31' ' C35' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.635 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.696 ' C46' ' C42' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.444 ' O3 ' ' C41' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.594 ' O31' ' C7 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.483 ' C5 ' ' C1 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.644 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.703 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.446 ' C38' ' C39' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.529 ' O3 ' ' O2P' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.614 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.538 ' P ' ' C6 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . 0.413 ' N ' ' O2B' ' B' ' 216' ' ' GNP . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . 0.418 ' C ' ' HG ' ' B' ' 106' ' ' SER . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' SER . . . . . 0.418 ' HG ' ' C ' ' B' ' 105' ' ' ASP . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -67.59 -38.32 83.84 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -77.28 -55.54 5.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.725 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 80.8 -114.12 3.77 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.098 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -112.92 -160.89 0.73 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.817 0.341 . . . . 10.0 110.682 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.26 143.29 48.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.213 0.53 . . . . 10.0 111.745 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -159.21 141.99 14.18 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.16 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 18.6 ttpp -71.09 102.54 2.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -132.67 101.18 5.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.62 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -63.16 102.24 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.791 0.682 . . . . 10.0 109.958 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.0 m -106.85 106.72 17.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.59 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -149.38 131.2 15.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.153 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.0 t -97.54 153.46 18.15 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp 63.93 -151.24 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.295 0.372 . . . . 10.0 111.18 -178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.836 0.351 . . . . 10.0 111.005 179.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.538 ' C22' ' C18' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.48 ' C31' ' O1P' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.579 ' C21' ' C17' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.572 ' C6 ' ' O4P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.756 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.523 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.486 ' C8 ' ' O31' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.642 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.635 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.432 ' O9 ' ' O8 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.608 ' P ' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.562 ' C1 ' ' C37' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.756 ' C41' ' C37' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.591 ' C33' ' C14' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.537 ' O3P' ' O31' ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.648 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.686 ' C42' ' C46' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.599 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.507 ' C4 ' ' C2 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.588 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.732 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.601 ' C21' ' C17' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.4 ' O11' ' C2 ' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.516 ' O31' ' C6 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.572 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.511 ' O11' ' C6 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.68 ' C21' ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.511 ' C6 ' ' O1P' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.655 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.701 ' C13' ' C17' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.572 ' C39' ' C16' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.627 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.572 ' C16' ' C39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.511 ' C6 ' ' O11' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.519 ' O1P' ' C5 ' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.537 ' C14' ' C6 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.62 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.66 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.6 ' O1P' ' C6 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.659 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.62 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.603 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.685 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.474 ' C1Z' ' C14' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.53 ' O10' ' O7 ' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.585 ' O8 ' ' C5 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.58 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.543 ' O10' ' C4 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.508 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.678 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.532 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.445 ' C23' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.504 ' O3 ' ' O31' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.565 ' P ' ' C3 ' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.533 ' C6 ' ' O4 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.709 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.469 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.537 ' C1 ' ' C11' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.616 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.661 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.533 ' O4 ' ' C6 ' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.565 ' O2 ' ' C8 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.542 ' O10' ' O7 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.413 ' O2B' ' N ' ' B' ' 14' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.467 ' C2 ' ' O11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.5 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.643 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.63 ' C4 ' ' O31' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.634 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.538 ' C3 ' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.472 ' C5 ' ' C32' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.822 ' C22' ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.474 ' C5 ' ' C1 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.672 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.569 ' O7 ' ' O10' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.505 ' C19' ' C19' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.465 ' C10' ' C35' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.767 ' HN1' ' C4 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.413 ' C35' ' C22' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.501 ' O11' ' O2 ' ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 242' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' C' ' 532' ' ' ARG . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 246' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 247' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 250' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 255' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 264' ' ' LYS . . . . . . . . . . . . . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 275' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 279' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 297' ' ' LYS . . . . . . . . . . . . . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 299' ' ' SER . . . . . . . . . . . . . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 300' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 301' ' ' LEU . . . . . . . . . . . . . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 306' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 310' ' ' ARG . . . . . . . . . . . . . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 363' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 366' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 367' ' ' ALA . . . . . . . . . . . . . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 458' ' ' ASP . . . . . 0.487 ' CG ' ' HZ2' ' C' ' 462' ' ' LYS . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 462' ' ' LYS . . . . . 0.487 ' HZ2' ' CG ' ' C' ' 458' ' ' ASP . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 465' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 469' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 473' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 495' ' ' LYS . . . . . . . . . . . . . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 497' ' ' SER . . . . . . . . . . . . . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 498' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 502' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 503' ' ' MET . . . . . . . . . . . . . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 506' ' ' ARG . . . . . . . . . . . . . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 512' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 514' ' ' LEU . . . . . . . . . . . . . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 515' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 519' ' ' ALA . . . . . . . . . . . . . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 520' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 532' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 242' ' ' GLU . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.458 ' NZ ' ' O3G' ' B' ' 216' ' ' GNP . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLU . . . . . 0.41 ' CD ' HH22 ' B' ' 68' ' ' ARG . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.41 HH22 ' CD ' ' B' ' 62' ' ' GLU . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' MET . . . . . . . . . . . . . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' ALA . . . . . 0.435 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -99.83 -39.47 8.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -78.15 -54.75 5.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.856 0.36 . . . . 10.0 111.299 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 127.99 -95.09 0.4 Allowed Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.736 -0.945 . . . . 10.0 110.736 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -168.98 48.7 0.04 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.209 0.528 . . . . 10.0 111.118 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -125.01 123.84 40.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.124 0.487 . . . . 10.0 111.808 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -80.53 125.25 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.496 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -147.71 -169.45 3.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.119 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 5.0 tmtm? 71.7 91.06 0.09 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.364 0.602 . . . . 10.0 111.377 179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -141.76 23.89 2.07 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.628 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 94.9 6.17 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.872 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -146.74 90.06 1.88 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.046 0.451 . . . . 10.0 110.856 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 4.4 t -102.4 131.71 48.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.467 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -169.25 -38.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.603 -0.271 . . . . 10.0 111.198 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--O 1.239 0.51 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.812 179.899 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 369' ' ' VAL . . . . . . . . . . . . . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 472' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 476' ' ' CYS . . . . . . . . . . . . . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' PCW . . . . . 0.54 ' C31' ' O3 ' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' PCW . . . . . 0.593 ' C5 ' ' O5 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' PCW . . . . . 0.589 ' C21' ' C17' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' PCW . . . . . 0.568 ' C6 ' ' O4P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' PCW . . . . . 0.757 ' C19' ' C14' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' PCW . . . . . 0.437 ' O3 ' ' O31' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' PCW . . . . . 0.615 ' C23' ' C27' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' PCW . . . . . 0.639 ' C43' ' C47' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' 17F . . . . . 0.659 ' O1 ' ' C2 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' 17F . . . . . 0.459 ' O6 ' ' O10' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' PCW . . . . . 0.542 ' O3P' ' O31' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' PCW . . . . . 0.579 ' C11' ' O31' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' PCW . . . . . 0.727 ' C35' ' C13' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' PCW . . . . . 0.489 ' O3 ' ' O31' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' PCW . . . . . 0.594 ' C37' ' C43' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' PCW . . . . . 0.439 ' C12' ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' PCW . . . . . 0.658 ' C24' ' C20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 601' ' ' PCW . . . . . 0.622 ' C43' ' C47' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 602' ' ' PCW . . . . . 0.575 ' O4P' ' C6 ' ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 603' ' ' PCW . . . . . 0.59 ' C4 ' ' C31' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 604' ' ' PCW . . . . . 0.611 ' O3 ' ' O31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 605' ' ' PCW . . . . . 0.731 ' P ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 606' ' ' PCW . . . . . 0.617 ' C14' ' C18' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 607' ' ' PCW . . . . . 0.551 ' C43' ' C1Z' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 608' ' ' PCW . . . . . 0.561 ' O31' ' C11' ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 609' ' ' PCW . . . . . 0.641 ' C20' ' C24' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 610' ' ' PCW . . . . . 0.563 ' O4P' ' C34' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 611' ' ' PCW . . . . . 0.727 ' C13' ' C35' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 612' ' ' PCW . . . . . 0.649 ' C5 ' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 613' ' ' PCW . . . . . 0.688 ' C42' ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 614' ' ' PCW . . . . . 0.514 ' C31' ' O3 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 615' ' ' PCW . . . . . 0.554 ' O3 ' ' O31' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 616' ' ' PCW . . . . . 0.641 ' C23' ' C27' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 617' ' ' PCW . . . . . 0.502 ' O2P' ' C4 ' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 618' ' ' PCW . . . . . 0.409 ' O4P' ' C8 ' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 619' ' ' PCW . . . . . 0.567 ' O1P' ' C5 ' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 620' ' ' PCW . . . . . 0.567 ' C5 ' ' O1P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 621' ' ' PCW . . . . . 0.615 ' C35' ' C20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 622' ' ' PCW . . . . . 0.663 ' C32' ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 623' ' ' PCW . . . . . 0.629 ' O1P' ' C5 ' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 624' ' ' PCW . . . . . 0.647 ' C23' ' C27' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 625' ' ' PCW . . . . . 0.615 ' C20' ' C35' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 626' ' ' 17F . . . . . 0.642 ' C19' ' C31' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 627' ' ' 17F . . . . . 0.73 ' C18' ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 628' ' ' 17F . . . . . 0.465 ' C1Y' ' C14' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 629' ' ' 17F . . . . . 0.559 ' O7 ' ' C17' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 630' ' ' 17F . . . . . 0.488 ' O6 ' ' O10' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 631' ' ' 17F . . . . . 0.553 ' O7 ' ' O10' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 632' ' ' 17F . . . . . 0.504 ' O4 ' ' C5 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' PCW . . . . . 0.599 ' C31' ' C35' ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' PCW . . . . . 0.616 ' C35' ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' PCW . . . . . 0.563 ' C6 ' ' O4P' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' PCW . . . . . 0.497 ' O3 ' ' O31' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' PCW . . . . . 0.45 ' C2 ' ' O1P' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' PCW . . . . . 0.539 ' C1 ' ' O31' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' PCW . . . . . 0.853 ' C20' ' C25' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' PCW . . . . . 0.675 ' C22' ' C26' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' PCW . . . . . 0.456 ' C2 ' ' O11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' PCW . . . . . 0.472 ' O3 ' ' O31' ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' PCW . . . . . 0.651 ' C22' ' C26' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' PCW . . . . . 0.65 ' C20' ' C24' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' 17F . . . . . 0.423 ' O1 ' ' C7 ' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' 17F . . . . . 0.539 ' C5 ' ' O8 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' 17F . . . . . 0.548 ' C6 ' ' C14' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' GNP . . . . . 0.458 ' O3G' ' NZ ' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 501' ' ' PCW . . . . . 0.481 ' O31' ' C11' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 502' ' ' PCW . . . . . 0.549 ' C11' ' O31' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 503' ' ' PCW . . . . . 0.647 ' C21' ' C25' ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 504' ' ' PCW . . . . . 0.563 ' C31' ' C35' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 505' ' ' PCW . . . . . 0.621 ' C25' ' C21' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 506' ' ' PCW . . . . . 0.645 ' C46' ' C42' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 507' ' ' PCW . . . . . 0.426 ' C5 ' ' O11' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 508' ' ' PCW . . . . . 0.815 ' C22' ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 509' ' ' PCW . . . . . 0.574 ' C6 ' ' O4P' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 510' ' ' PCW . . . . . 0.674 ' C43' ' C47' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 511' ' ' 17F . . . . . 0.692 ' C19' ' C31' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 512' ' ' 17F . . . . . 0.439 ' C19' ' C19' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 513' ' ' 17F . . . . . 0.593 ' O5 ' ' C5 ' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 514' ' ' 17F . . . . . 0.683 ' N1 ' ' O2 ' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 515' ' ' PCW . . . . . 0.516 ' C35' ' C22' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 516' ' ' PCW . . . . . 0.543 ' C34' ' C34' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 206' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 218' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 221' ' ' LEU . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 220' ' ' GLN . . . . . 0.467 ' O ' HG23 ' A' ' 224' ' ' VAL . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 218' ' ' ARG . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 224' ' ' VAL . . . . . 0.67 HG22 ' HD3' ' C' ' 550' ' ' LYS . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 228' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.621 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.621 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.41 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.652 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 250' ' ' VAL . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.805 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 254' ' ' VAL . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.805 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.464 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.467 ' HG ' HG22 ' A' ' 254' ' ' VAL . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.665 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 273' ' ' ARG . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.718 ' HG2' HD21 ' C' ' 499' ' ' LEU . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.458 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.575 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 290' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.464 ' HB3' HD12 ' A' ' 301' ' ' LEU . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.527 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' C' ' 473' ' ' LYS . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 304' ' ' GLU . . . . . 0.406 ' OE2' HD22 ' C' ' 469' ' ' LEU . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.431 ' HG3' HD11 ' C' ' 469' ' ' LEU . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.664 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 315' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 319' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.469 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.762 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.4 ' HD3' HH11 ' A' ' 330' ' ' ARG . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 338' ' ' LEU . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 353' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 363' ' ' LYS . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 361' ' ' SER . . . . . 0.57 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 364' ' ' ALA . . . . . 0.721 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.982 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.982 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.67 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 364' ' ' ALA . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 376' ' ' LEU . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 379' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 384' ' ' VAL . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 380' ' ' GLU . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.92 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' SER . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.806 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 400' ' ' LYS . . . . . 0.42 ' HB3' ' HB2' ' C' ' 403' ' ' ASP . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 403' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' C' ' 400' ' ' LYS . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.416 ' O ' HG23 ' C' ' 408' ' ' VAL . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.416 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.645 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.459 ' HD1' HD12 ' C' ' 415' ' ' LEU . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' C' ' 411' ' ' THR . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.549 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.473 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.486 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' C' ' 435' ' ' GLU . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 437' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' C' ' 440' ' ' GLU . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.476 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' C' ' 437' ' ' LEU . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 441' ' ' MET . . . . . 0.476 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.732 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.563 ' O ' HG12 ' C' ' 448' ' ' VAL . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.732 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.615 HG23 HG22 ' C' ' 448' ' ' VAL . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' C' ' 456' ' ' LEU . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.634 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.644 ' HA ' ' CG ' ' C' ' 475' ' ' GLU . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.534 ' HG2' HD13 ' A' ' 301' ' ' LEU . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.644 ' CG ' ' HA ' ' C' ' 471' ' ' ARG . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' C' ' 477' ' ' LEU . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' C' ' 475' ' ' GLU . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB3' ' NH1' ' C' ' 486' ' ' ARG . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 486' ' ' ARG . . . . . 0.417 ' NH1' ' HB3' ' C' ' 482' ' ' GLN . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 492' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' C' ' 496' ' ' LEU . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.437 ' HE3' HD22 ' A' ' 279' ' ' LEU . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' C' ' 492' ' ' LEU . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.78 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.78 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 275' ' ' LYS . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.505 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' C' ' 508' ' ' ARG . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' C' ' 505' ' ' ASP . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.665 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.558 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.524 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 513' ' ' ALA . . . . . 0.431 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.677 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.652 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.458 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 535' ' ' ALA . . . . . 0.515 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 539' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.67 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 570' ' ' ARG . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HA ' HG12 ' C' ' 576' ' ' VAL . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.493 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' C' ' 577' ' ' LEU . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.511 ' O ' HG23 ' C' ' 582' ' ' VAL . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 578' ' ' GLU . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.806 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.92 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' HB ' ' B' ' 50' ' ' THR . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' B' ' 52' ' ' LEU . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.649 HD11 HD22 ' B' ' 53' ' ' LEU . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.654 HG12 ' HB2' ' B' ' 79' ' ' LEU . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLY . . . . . 0.479 ' HA2' ' HE1' ' B' ' 32' ' ' TYR . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.412 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.497 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.494 HD13 HG12 ' B' ' 152' ' ' VAL . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' B' ' 42' ' ' LYS . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.484 ' CD ' ' H ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.479 ' HE1' ' HA2' ' B' ' 13' ' ' GLY . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.761 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HB2' HD12 ' B' ' 24' ' ' ILE . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.528 ' HB2' HH12 ' B' ' 164' ' ' ARG . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 51' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 3' ' ' GLU . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.649 HD22 HD11 ' B' ' 6' ' ' LEU . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.431 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' TYR . . . . . 0.414 ' HE1' ' NH2' ' B' ' 102' ' ' ARG . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.616 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.646 ' HA3' HD21 ' B' ' 159' ' ' LEU . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.849 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' B' ' 8' ' ' VAL . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.412 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.79 HD11 ' HA ' ' B' ' 118' ' ' CYS . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 93' ' ' ILE . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.45 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' ARG . . . . . 0.414 ' NH2' ' HE1' ' B' ' 64' ' ' TYR . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.45 HG23 ' O ' ' B' ' 99' ' ' GLN . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.849 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.678 HG13 ' HG2' ' B' ' 140' ' ' PRO . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' B' ' 141' ' ' PHE . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.613 HG22 ' HB ' ' B' ' 142' ' ' ILE . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.484 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.79 ' HA ' HD11 ' B' ' 84' ' ' ILE . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.484 HD12 ' HB3' ' B' ' 117' ' ' LYS . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.699 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.533 ' HG3' HD12 ' B' ' 84' ' ' ILE . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.458 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.479 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.678 ' HG2' HG13 ' B' ' 112' ' ' VAL . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' B' ' 113' ' ' LEU . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 142' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' B' ' 114' ' ' VAL . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.527 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' VAL . . . . . 0.494 HG12 HD13 ' B' ' 23' ' ' LEU . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.647 HD23 HD22 ' B' ' 6' ' ' LEU . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.528 HH12 ' HB2' ' B' ' 47' ' ' ASP . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 165' ' ' LYS . . . . . 0.467 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 168' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' B' ' 172' ' ' LYS . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 169' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 165' ' ' LYS . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 172' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 168' ' ' GLU . 52.5 mtmt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 360' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' D' ' 368' ' ' THR . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 361' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' D' ' 427' ' ' GLN . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.623 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.623 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 364' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' D' ' 436' ' ' LEU . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.535 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.761 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 372' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' D' ' 381' ' ' CYS . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 373' ' ' ARG . . . . . 0.475 ' HG3' ' H ' ' D' ' 374' ' ' ASN . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 374' ' ' ASN . . . . . 0.475 ' H ' ' HG3' ' D' ' 373' ' ' ARG . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.501 HD22 HD22 ' D' ' 426' ' ' LEU . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 379' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' D' ' 382' ' ' LEU . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 381' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.858 HD21 HG21 ' D' ' 428' ' ' VAL . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 386' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' D' ' 393' ' ' PRO . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 393' ' ' PRO . . . . . 0.468 ' HD3' HD21 ' D' ' 386' ' ' LEU . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 395' ' ' CYS . . . . . 0.685 ' HA ' ' HB3' ' D' ' 432' ' ' ASP . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 396' ' ' CYS . . . . . 0.503 ' HB3' HG12 ' D' ' 428' ' ' VAL . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.434 ' HB3' ' HB3' ' D' ' 409' ' ' LYS . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' D' ' 426' ' ' LEU . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 401' ' ' LEU . . . . . 0.48 HD13 ' HB2' ' D' ' 425' ' ' GLU . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.44 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.434 ' HB3' ' HB3' ' D' ' 399' ' ' PHE . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 410' ' ' ALA . . . . . 0.491 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.463 ' HA ' HD23 ' D' ' 412' ' ' LEU . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.463 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.48 ' HB2' HD13 ' D' ' 401' ' ' LEU . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.523 HD12 ' HA ' ' D' ' 400' ' ' ARG . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 427' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' D' ' 361' ' ' PHE . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.858 HG21 HD21 ' D' ' 382' ' ' LEU . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 432' ' ' ASP . . . . . 0.685 ' HB3' ' HA ' ' D' ' 395' ' ' CYS . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 434' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 435' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 436' ' ' LEU . . . . . 0.527 ' HA ' ' HB2' ' D' ' 364' ' ' ASN . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' D' ' 459' ' ' LEU . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 455' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 456' ' ' GLN . . . . . 0.489 ' O ' ' HD2' ' D' ' 457' ' ' LYS . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 457' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' D' ' 456' ' ' GLN . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.64 ' HB2' ' HB2' ' D' ' 452' ' ' CYS . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.423 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.423 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' D' ' 470' ' ' TYR . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 470' ' ' TYR . . . . . 0.415 ' HB3' ' SG ' ' D' ' 465' ' ' CYS . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.963 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.963 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 481' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 483' ' ' MET . . . . . 0.582 ' HG3' ' H ' ' D' ' 484' ' ' CYS . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.582 ' H ' ' HG3' ' D' ' 483' ' ' MET . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 206' ' ' ASN . . . . . 0.537 HD21 HD21 ' C' ' 569' ' ' LEU . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 213' ' ' THR . . . . . 0.528 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 213' ' ' THR . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 225' ' ' THR . . . . . 0.585 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.585 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.641 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.551 ' O ' ' HG3' ' A' ' 240' ' ' ARG . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.518 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 236' ' ' THR . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.631 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 250' ' ' VAL . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.71 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.447 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.534 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 9.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.489 ' HG ' HG22 ' A' ' 254' ' ' VAL . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.458 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.563 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 268' ' ' GLU . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 265' ' ' TRP . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.419 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.41 ' O ' HG12 ' A' ' 276' ' ' VAL . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.741 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.589 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 289' ' ' GLN . . . . . 0.406 ' HG2' ' OE2' ' A' ' 293' ' ' GLU . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 292' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 289' ' ' GLN . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.596 ' HG3' HD21 ' C' ' 477' ' ' LEU . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.509 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.567 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.567 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.599 ' HB3' ' HE3' ' C' ' 473' ' ' LYS . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.509 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.51 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.682 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.592 ' HG3' HD21 ' C' ' 469' ' ' LEU . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.682 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' A' ' 320' ' ' LEU . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.522 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.69 HD23 ' HD2' ' A' ' 330' ' ' ARG . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.751 HH21 ' HB3' ' C' ' 447' ' ' GLU . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.437 ' HG2' ' OE1' ' C' ' 440' ' ' GLU . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.511 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.761 HD21 ' HB3' ' C' ' 432' ' ' LYS . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.511 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 346' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.5 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 356' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.783 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.792 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.792 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.783 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 375' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 379' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.663 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 393' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 397' ' ' LEU . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.718 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 397' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 393' ' ' TYR . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 401' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.438 ' O ' HG23 ' C' ' 408' ' ' VAL . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 405' ' ' TRP . . . . . 0.461 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.438 HG23 ' O ' ' C' ' 404' ' ' ASN . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.415 HG23 ' HE2' ' A' ' 363' ' ' LYS . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.42 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' C' ' 413' ' ' SER . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 418' ' ' GLN . . . . . 0.578 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.509 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.761 ' HB3' HD21 ' A' ' 341' ' ' ASN . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 345' ' ' ARG . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.437 ' OE1' ' HG2' ' A' ' 334' ' ' ARG . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.733 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.441 ' O ' HG12 ' C' ' 448' ' ' VAL . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.751 ' HB3' HH21 ' A' ' 330' ' ' ARG . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.733 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' C' ' 456' ' ' LEU . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.51 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' C' ' 452' ' ' VAL . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 468' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' C' ' 471' ' ' ARG . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.592 HD21 ' HG3' ' A' ' 308' ' ' ARG . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' C' ' 468' ' ' GLU . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.599 ' HE3' ' HB3' ' A' ' 301' ' ' LEU . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 474' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.596 HD21 ' HG3' ' A' ' 297' ' ' LYS . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.741 ' HE3' HD22 ' A' ' 279' ' ' LEU . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.558 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.885 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.437 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 504' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.654 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.563 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.444 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 513' ' ' ALA . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.586 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.67 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.646 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.458 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.631 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.565 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.721 HD23 HD12 ' C' ' 536' ' ' LEU . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.721 HD12 HD23 ' C' ' 533' ' ' LEU . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 543' ' ' ARG . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 548' ' ' HIS . . . . . 0.596 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' C' ' 558' ' ' LEU . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 565' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.537 HD21 HD21 ' A' ' 206' ' ' ASN . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.573 ' HA ' HG12 ' C' ' 576' ' ' VAL . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.573 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.538 ' O ' HG23 ' C' ' 582' ' ' VAL . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.538 HG23 ' O ' ' C' ' 578' ' ' GLU . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 584' ' ' PHE . . . . . 0.525 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.718 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 588' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.663 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.583 ' HB2' ' HG3' ' B' ' 76' ' ' GLU . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.644 HD22 HD23 ' B' ' 159' ' ' LEU . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' B' ' 80' ' ' CYS . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.425 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.656 HD13 HG11 ' D' ' 388' ' ' VAL . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.469 HD22 HG12 ' B' ' 152' ' ' VAL . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.582 HD13 ' HD3' ' B' ' 42' ' ' LYS . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.661 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.706 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.448 ' HB3' HG13 ' B' ' 24' ' ' ILE . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.582 ' HD3' HD13 ' B' ' 24' ' ' ILE . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' D' ' 467' ' ' THR . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 44' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' B' ' 46' ' ' ILE . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' D' ' 464' ' ' ARG . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.502 HG13 ' HB ' ' B' ' 44' ' ' VAL . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' D' ' 448' ' ' LYS . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.547 ' HA ' ' HE3' ' D' ' 471' ' ' LYS . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.475 HD22 HD11 ' B' ' 6' ' ' LEU . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.661 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.434 ' HE3' HG21 ' B' ' 103' ' ' VAL . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' GLU . . . . . 0.583 ' HG3' ' HB2' ' B' ' 5' ' ' LYS . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.52 ' O ' ' HA ' ' B' ' 111' ' ' MET . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.947 ' HG ' HD22 ' B' ' 159' ' ' LEU . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.523 ' HB2' HD12 ' B' ' 93' ' ' ILE . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.696 HG12 ' HB ' ' B' ' 114' ' ' VAL . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.558 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.925 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.558 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' ASN . . . . . 0.48 ' ND2' ' HB3' ' B' ' 88' ' ' LYS . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LYS . . . . . 0.48 ' HB3' ' ND2' ' B' ' 86' ' ' ASN . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.504 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' B' ' 82' ' ' PHE . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 97' ' ' ARG . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.435 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 99' ' ' GLN . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' SER . . . . . 0.473 ' HB2' HG13 ' B' ' 109' ' ' VAL . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' VAL . . . . . 0.473 HG13 ' HB2' ' B' ' 106' ' ' SER . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' B' ' 109' ' ' VAL . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.618 ' HB ' HD23 ' B' ' 79' ' ' LEU . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.696 ' HB ' HG12 ' B' ' 81' ' ' VAL . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' B' ' 144' ' ' THR . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.925 ' HA ' HD11 ' B' ' 84' ' ' ILE . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.871 ' HG3' HD12 ' B' ' 84' ' ' ILE . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.613 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.529 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.613 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' B' ' 127' ' ' THR . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ALA . . . . . 0.444 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.444 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.459 ' HG2' HG13 ' B' ' 112' ' ' VAL . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 23' ' ' LEU . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ASP . . . . . 0.466 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.466 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.568 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.947 HD22 ' HG ' ' B' ' 79' ' ' LEU . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.536 ' HG3' HG22 ' D' ' 369' ' ' VAL . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.748 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.748 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 364' ' ' ASN . . . . . 0.458 ' HB3' ' H ' ' D' ' 365' ' ' LYS . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 365' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' D' ' 364' ' ' ASN . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.706 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.428 HD12 ' O ' ' D' ' 413' ' ' ASP . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.656 HD21 HG21 ' D' ' 428' ' ' VAL . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 387' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.656 HG11 HD13 ' B' ' 21' ' ' ILE . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 389' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 397' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.639 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.639 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' D' ' 413' ' ' ASP . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 413' ' ' ASP . . . . . 0.47 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' D' ' 359' ' ' ARG . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.656 HG21 HD21 ' D' ' 382' ' ' LEU . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 430' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' D' ' 433' ' ' HIS . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.533 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 433' ' ' HIS . . . . . 0.412 ' HB3' ' HB3' ' D' ' 430' ' ' PHE . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 435' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' D' ' 436' ' ' LEU . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 436' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' D' ' 436' ' ' LEU . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.414 ' CE1' ' SG ' ' D' ' 465' ' ' CYS . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 444' ' ' LYS . . . . . 0.698 ' HB2' ' HD3' ' D' ' 464' ' ' ARG . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 447' ' ' LEU . . . . . 0.426 HD12 ' H ' ' B' ' 47' ' ' ASP . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 448' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 47' ' ' ASP . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 450' ' ' ALA . . . . . 0.497 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 451' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 455' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 458' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.785 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.45 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.698 ' HD3' ' HB2' ' D' ' 444' ' ' LYS . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.662 ' HB2' ' H ' ' D' ' 470' ' ' TYR . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 467' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' B' ' 43' ' ' GLN . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 469' ' ' GLY . . . . . 0.562 ' N ' ' HB2' ' D' ' 465' ' ' CYS . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 470' ' ' TYR . . . . . 0.662 ' H ' ' HB2' ' D' ' 465' ' ' CYS . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.785 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.814 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 473' ' ' HIS . . . . . 0.54 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.417 ' HA ' HD12 ' A' ' 204' ' ' LEU . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 201' ' ' LEU . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 213' ' ' THR . . . . . 0.468 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 222' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 226' ' ' GLN . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 225' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 226' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 222' ' ' GLY . 66.2 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.642 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.869 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.869 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 235' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 239' ' ' LEU . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.559 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 235' ' ' GLU . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.559 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.749 ' HG3' HD12 ' A' ' 247' ' ' LEU . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.593 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.569 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.749 HD12 ' HG3' ' A' ' 243' ' ' MET . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.593 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.575 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.575 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.533 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.533 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.408 ' HG ' HG22 ' A' ' 254' ' ' VAL . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.603 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.464 ' O ' ' HB2' ' A' ' 269' ' ' MET . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 269' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 265' ' ' TRP . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 274' ' ' GLN . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 274' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 270' ' ' GLU . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.707 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.435 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.471 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 286' ' ' GLY . . . . . 0.403 ' O ' ' HG3' ' A' ' 290' ' ' LYS . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 290' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 286' ' ' GLY . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.484 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.42 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.771 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.771 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' C' ' 473' ' ' LYS . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.592 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.619 ' HG3' HD11 ' C' ' 469' ' ' LEU . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.592 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.582 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.67 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.67 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.595 HH21 ' HB3' ' C' ' 447' ' ' GLU . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.55 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.55 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.502 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 364' ' ' ALA . . . . . 0.461 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.884 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.884 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 364' ' ' ALA . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 368' ' ' LEU . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 375' ' ' LEU . . . . . 0.418 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 379' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 375' ' ' LEU . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 384' ' ' VAL . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 380' ' ' GLU . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.461 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.615 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.491 ' O ' HG23 ' C' ' 408' ' ' VAL . 58.8 t30 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.491 HG23 ' O ' ' C' ' 404' ' ' ASN . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.568 ' HD1' HD12 ' C' ' 415' ' ' LEU . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.568 HD12 ' HD1' ' C' ' 412' ' ' PHE . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.419 ' HA ' HD12 ' C' ' 430' ' ' LEU . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.502 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' C' ' 427' ' ' TRP . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 436' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' C' ' 440' ' ' GLU . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 437' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 436' ' ' GLY . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.578 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.595 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.619 HD11 ' HG3' ' A' ' 308' ' ' ARG . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.666 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.62 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 483' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' C' ' 487' ' ' GLN . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' C' ' 483' ' ' GLU . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 493' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.668 ' HE3' HD22 ' A' ' 279' ' ' LEU . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.519 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.883 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.883 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.621 HD21 ' HG2' ' A' ' 275' ' ' LYS . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.519 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.534 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.58 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.58 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.603 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.569 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' C' ' 515' ' ' ARG . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' C' ' 519' ' ' ALA . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 1.8 m-70 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.69 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' C' ' 526' ' ' ARG . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' C' ' 522' ' ' SER . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.569 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.601 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.677 ' HB3' ' HE3' ' C' ' 563' ' ' LYS . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.677 ' HE3' ' HB3' ' C' ' 559' ' ' SER . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 571' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.531 ' HA ' HG12 ' C' ' 576' ' ' VAL . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' C' ' 581' ' ' LYS . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' C' ' 578' ' ' GLU . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.615 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.591 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.885 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 152' ' ' VAL . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.832 HG23 ' HD3' ' B' ' 42' ' ' LYS . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PHE . . . . . 0.486 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.804 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.871 ' HB3' HG23 ' D' ' 369' ' ' VAL . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.799 ' HE1' ' HB2' ' B' ' 57' ' ' ASP . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.832 ' HD3' HG23 ' B' ' 24' ' ' ILE . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' VAL . . . . . 0.489 HG12 ' NH2' ' D' ' 464' ' ' ARG . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' HD12 ' D' ' 447' ' ' LEU . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.695 ' HA ' ' HD3' ' D' ' 448' ' ' LYS . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' GLY . . . . . 0.729 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' B' ' 40' ' ' TYR . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB2' ' HE1' ' B' ' 40' ' ' TYR . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.804 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.442 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 73' ' ' ARG . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.813 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' B' ' 112' ' ' VAL . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 113' ' ' LEU . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' B' ' 114' ' ' VAL . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.404 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.765 HD11 ' HA ' ' B' ' 118' ' ' CYS . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' B' ' 82' ' ' PHE . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' HIS . . . . . 0.453 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.518 ' O ' HG23 ' B' ' 103' ' ' VAL . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 99' ' ' GLN . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.813 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.693 ' HB ' HD23 ' B' ' 79' ' ' LEU . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' B' ' 80' ' ' CYS . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.54 ' HB ' HG12 ' B' ' 81' ' ' VAL . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.765 ' HA ' HD11 ' B' ' 84' ' ' ILE . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.485 ' NH2' ' HB2' ' B' ' 118' ' ' CYS . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.512 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' B' ' 133' ' ' LEU . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 142' ' ' ILE . . . . . 0.741 HG21 ' HB2' ' B' ' 155' ' ' ALA . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.643 ' HB ' HG22 ' B' ' 152' ' ' VAL . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.885 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' VAL . . . . . 0.643 HG22 ' HB ' ' B' ' 144' ' ' THR . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' ALA . . . . . 0.741 ' HB2' HG21 ' B' ' 142' ' ' ILE . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.591 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.678 HD22 ' HG ' ' B' ' 79' ' ' LEU . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.591 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 162' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.432 HG13 ' O ' ' B' ' 159' ' ' LEU . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' B' ' 164' ' ' ARG . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 165' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' B' ' 165' ' ' LYS . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.439 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 361' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' D' ' 426' ' ' LEU . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.511 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.511 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 367' ' ' ARG . . . . . 0.543 ' HD2' ' OE1' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.871 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.447 ' HB2' HD11 ' B' ' 36' ' ' ILE . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 373' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 377' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' D' ' 417' ' ' ASP . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' D' ' 416' ' ' THR . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.819 HD21 HG21 ' D' ' 428' ' ' VAL . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.591 ' CG1' HD13 ' B' ' 21' ' ' ILE . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.434 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 401' ' ' LEU . . . . . 0.58 HD13 ' HB2' ' D' ' 425' ' ' GLU . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 403' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' D' ' 403' ' ' GLN . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 410' ' ' ALA . . . . . 0.434 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.435 HD13 HG21 ' D' ' 416' ' ' THR . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 413' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.494 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 417' ' ' ASP . . . . . 0.663 ' HA ' ' HA ' ' D' ' 377' ' ' SER . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.58 ' HB2' HD13 ' D' ' 401' ' ' LEU . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.819 HG21 HD21 ' D' ' 382' ' ' LEU . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.466 ' HB2' ' H ' ' D' ' 432' ' ' ASP . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 432' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 437' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 467' ' ' THR . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.463 ' HA ' ' SG ' ' D' ' 468' ' ' CYS . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 442' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 443' ' ' ARG . . . . . 0.435 ' HB3' ' CE1' ' D' ' 463' ' ' PHE . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 447' ' ' LEU . . . . . 0.488 HD12 ' O ' ' B' ' 45' ' ' VAL . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 448' ' ' LYS . . . . . 0.695 ' HD3' ' HA ' ' B' ' 47' ' ' ASP . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 449' ' ' LEU . . . . . 0.599 ' H ' ' HG2' ' D' ' 448' ' ' LYS . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 450' ' ' ALA . . . . . 0.729 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.657 ' HA ' HD23 ' D' ' 459' ' ' LEU . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 457' ' ' LYS . . . . . 0.556 ' HG2' ' H ' ' D' ' 458' ' ' PHE . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 458' ' ' PHE . . . . . 0.556 ' H ' ' HG2' ' D' ' 457' ' ' LYS . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.657 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.48 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 463' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' D' ' 443' ' ' ARG . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.489 ' NH2' HG12 ' B' ' 44' ' ' VAL . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.443 ' CB ' ' SG ' ' D' ' 468' ' ' CYS . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 467' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 437' ' ' THR . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.651 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.993 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.993 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.572 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 204' ' ' LEU . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.414 HD12 HD23 ' A' ' 201' ' ' LEU . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' A' ' 229' ' ' TRP . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.769 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.769 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.49 ' HB ' ' CZ ' ' A' ' 240' ' ' ARG . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 236' ' ' THR . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.643 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.653 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' HG12 ' A' ' 250' ' ' VAL . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.539 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.458 ' O ' HG12 ' A' ' 254' ' ' VAL . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.585 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.585 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.411 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.57 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.52 ' NZ ' ' HB2' ' C' ' 513' ' ' ALA . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.484 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.413 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.763 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 272' ' ' TYR . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.452 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 295' ' ' GLN . . . . . 0.542 ' HA ' ' HB2' ' A' ' 298' ' ' LEU . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 295' ' ' GLN . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.797 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.797 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.609 ' HG3' HD21 ' C' ' 469' ' ' LEU . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.561 ' HA ' HD12 ' A' ' 316' ' ' LEU . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 313' ' ' VAL . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.513 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.453 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.477 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.513 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.535 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.653 HD23 ' HD2' ' A' ' 330' ' ' ARG . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 324' ' ' SER . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.653 ' HD2' HD23 ' A' ' 327' ' ' LEU . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.661 ' HD3' ' OE1' ' C' ' 440' ' ' GLU . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.436 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.446 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 361' ' ' SER . . . . . 0.417 ' HB3' ' HE2' ' A' ' 365' ' ' LYS . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.713 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.846 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.846 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.713 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.401 ' O ' HG23 ' A' ' 384' ' ' VAL . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 380' ' ' GLU . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.573 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.504 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 395' ' ' LYS . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.751 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.577 ' O ' HG23 ' C' ' 408' ' ' VAL . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.577 HG23 ' O ' ' C' ' 404' ' ' ASN . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.442 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' C' ' 413' ' ' SER . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.661 ' OE1' ' HD3' ' A' ' 334' ' ' ARG . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 457' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.468 ' HD2' ' CZ2' ' C' ' 463' ' ' TRP . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.468 ' CZ2' ' HD2' ' C' ' 459' ' ' PHE . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.62 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.609 HD21 ' HG3' ' A' ' 308' ' ' ARG . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.484 ' HE2' HD22 ' C' ' 469' ' ' LEU . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 485' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.438 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.582 ' HE3' HD22 ' A' ' 279' ' ' LEU . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.504 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.565 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 279' ' ' LEU . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.623 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.623 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.529 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.668 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 513' ' ' ALA . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.614 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.614 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.664 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.576 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.653 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 529' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.437 HD23 HD12 ' C' ' 536' ' ' LEU . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.403 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.437 HD12 HD23 ' C' ' 533' ' ' LEU . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.424 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.545 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 568' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.458 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.751 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 592' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 596' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' C' ' 592' ' ' THR . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' B' ' 50' ' ' THR . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.432 ' HG3' HD23 ' B' ' 52' ' ' LEU . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.748 HG12 ' HB2' ' B' ' 79' ' ' LEU . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.493 HG21 HD11 ' B' ' 100' ' ' ILE . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.598 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.488 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.536 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.464 HG23 ' HD3' ' B' ' 42' ' ' LYS . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.449 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.679 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.749 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HD3' HG23 ' B' ' 24' ' ' ILE . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.621 ' O ' ' HA3' ' D' ' 469' ' ' GLY . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' GLY . . . . . 0.539 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' B' ' 1' ' ' MET . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' B' ' 3' ' ' GLU . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.679 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.458 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' TYR . . . . . 0.425 ' HE1' ' HB2' ' B' ' 69' ' ' ASP . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.535 ' HA ' ' CE1' ' B' ' 71' ' ' TYR . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.425 ' HB2' ' HE1' ' B' ' 64' ' ' TYR . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' B' ' 73' ' ' ARG . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.487 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.748 ' HB2' HG12 ' B' ' 8' ' ' VAL . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.626 HG12 ' HB ' ' B' ' 114' ' ' VAL . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.505 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.544 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' ASN . . . . . 0.474 HD21 ' HB3' ' B' ' 88' ' ' LYS . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' B' ' 86' ' ' ASN . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.587 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 89' ' ' SER . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' B' ' 93' ' ' ILE . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 103' ' ' VAL . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.493 HD11 HG21 ' B' ' 9' ' ' VAL . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 99' ' ' GLN . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.453 ' HD3' ' HZ ' ' B' ' 78' ' ' PHE . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.487 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.478 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 93' ' ' ILE . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.626 ' HB ' HG12 ' B' ' 81' ' ' VAL . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.691 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.405 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' B' ' 117' ' ' LYS . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.505 ' HG3' HD13 ' B' ' 84' ' ' ILE . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.799 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.421 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.799 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 127' ' ' THR . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.512 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.471 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 145' ' ' SER . . . . . 0.691 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.536 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' VAL . . . . . 0.407 HG22 ' CG2' ' B' ' 144' ' ' THR . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' PHE . . . . . 0.435 ' O ' HG23 ' B' ' 160' ' ' VAL . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' THR . . . . . 0.567 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.562 HD22 ' HG ' ' B' ' 79' ' ' LEU . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 156' ' ' PHE . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.538 HG22 ' HE2' ' B' ' 167' ' ' LYS . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' B' ' 164' ' ' ARG . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.538 ' HE2' HG22 ' B' ' 163' ' ' ILE . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 168' ' ' GLU . . . . . 0.504 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 172' ' ' LYS . . . . . 0.504 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 56.5 mtmt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 358' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' D' ' 369' ' ' VAL . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.715 ' HG2' HG22 ' D' ' 369' ' ' VAL . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.966 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.825 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 365' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 365' ' ' LYS . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.966 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.749 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.518 ' HB2' HD11 ' B' ' 36' ' ' ILE . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 426' ' ' LEU . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.501 HD21 HG21 ' D' ' 428' ' ' VAL . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 386' ' ' LEU . . . . . 0.477 HD21 ' HD3' ' D' ' 393' ' ' PRO . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.488 ' CG1' HD13 ' B' ' 21' ' ' ILE . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 393' ' ' PRO . . . . . 0.477 ' HD3' HD21 ' D' ' 386' ' ' LEU . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 395' ' ' CYS . . . . . 0.521 ' HA ' HD11 ' D' ' 431' ' ' LEU . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.422 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.492 ' HD2' HD21 ' D' ' 412' ' ' LEU . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 402' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' D' ' 409' ' ' LYS . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 406' ' ' LYS . . . . . 0.412 ' HE2' ' HB3' ' D' ' 406' ' ' LYS . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.619 ' HA ' HD21 ' D' ' 402' ' ' LEU . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.492 HD21 ' HD2' ' D' ' 400' ' ' ARG . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 378' ' ' LEU . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.501 HG21 HD21 ' D' ' 382' ' ' LEU . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 429' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 430' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' D' ' 395' ' ' CYS . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 432' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 434' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 435' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 437' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 467' ' ' THR . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 446' ' ' PHE . . . . . 0.516 ' HD1' ' HA ' ' D' ' 461' ' ' ASN . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 450' ' ' ALA . . . . . 0.539 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 455' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' D' ' 459' ' ' LEU . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.516 ' HA ' ' HD1' ' D' ' 446' ' ' PHE . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 463' ' ' PHE . . . . . 0.43 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.563 ' HB2' ' H ' ' D' ' 469' ' ' GLY . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 467' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 437' ' ' THR . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' D' D ' 469' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' B' ' 43' ' ' GLN . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 474' ' ' GLU . . . . . 0.43 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.425 HG22 ' H ' ' D' ' 482' ' ' THR . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 482' ' ' THR . . . . . 0.425 ' H ' HG22 ' D' ' 480' ' ' VAL . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 485' ' ' VAL . . . . . 0.683 HG12 ' HZ3' ' D' ' 487' ' ' TRP . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' D' D ' 487' ' ' TRP . . . . . 0.683 ' HZ3' HG12 ' D' ' 485' ' ' VAL . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.562 ' HA ' HD12 ' A' ' 204' ' ' LEU . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 201' ' ' LEU . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 224' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' C' ' 550' ' ' LYS . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 225' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 228' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 232' ' ' LEU . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 232' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 228' ' ' PHE . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 241' ' ' GLN . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 241' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 237' ' ' GLU . 23.6 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.607 ' HA ' ' CZ ' ' C' ' 528' ' ' ARG . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 250' ' ' VAL . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.724 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.426 ' O ' HG12 ' A' ' 254' ' ' VAL . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.51 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.592 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.575 ' HA ' HG12 ' A' ' 276' ' ' VAL . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 274' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 274' ' ' GLN . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' C' ' 499' ' ' LEU . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.761 HD22 ' HE3' ' C' ' 495' ' ' LYS . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 283' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 279' ' ' LEU . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 291' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 291' ' ' LEU . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 298' ' ' LEU . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.558 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.648 HD22 ' HG2' ' C' ' 473' ' ' LYS . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.445 ' HG3' HD21 ' C' ' 469' ' ' LEU . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.725 ' HA ' HD12 ' A' ' 316' ' ' LEU . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 317' ' ' ARG . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.575 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.47 ' HA ' HD12 ' A' ' 331' ' ' LEU . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.55 HH21 ' HB3' ' C' ' 447' ' ' GLU . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 331' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 328' ' ' ARG . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.442 ' O ' ' HG ' ' A' ' 338' ' ' LEU . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.42 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 53.5 t30 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.448 ' HA2' ' HE ' ' A' ' 345' ' ' ARG . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 344' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 348' ' ' GLU . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' C' ' 433' ' ' GLU . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.529 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 353' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.769 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 364' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 368' ' ' LEU . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.906 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.906 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 371' ' ' LEU . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.513 HD12 HD23 ' A' ' 368' ' ' LEU . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.447 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.454 ' O ' HG23 ' A' ' 384' ' ' VAL . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 380' ' ' GLU . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.531 ' HB2' ' CE ' ' C' ' 594' ' ' LYS . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 400' ' ' LYS . . . . . 0.451 ' HE2' ' HB2' ' C' ' 400' ' ' LYS . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' C' ' 415' ' ' LEU . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' C' ' 412' ' ' PHE . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.491 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.529 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.42 ' HB3' ' OD1' ' A' ' 341' ' ' ASN . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.449 ' HG2' ' HD3' ' A' ' 345' ' ' ARG . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.55 ' HB3' HH21 ' A' ' 330' ' ' ARG . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 456' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' C' ' 456' ' ' LEU . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 459' ' ' PHE . . . . . 0.454 ' HD1' ' HA ' ' C' ' 459' ' ' PHE . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.648 ' HG2' HD22 ' A' ' 301' ' ' LEU . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.433 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.761 ' HE3' HD22 ' A' ' 279' ' ' LEU . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.494 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.509 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.73 HD21 ' HG2' ' A' ' 275' ' ' LYS . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.747 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.609 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.777 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.777 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 1.3 m-70 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.605 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.605 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.48 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.607 ' CZ ' ' HA ' ' A' ' 246' ' ' ASP . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.467 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.459 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.413 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 557' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' C' ' 560' ' ' GLU . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 560' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' C' ' 557' ' ' THR . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 562' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 563' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' C' ' 567' ' ' GLU . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' C' ' 563' ' ' LYS . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 567' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 563' ' ' LYS . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 570' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 572' ' ' GLY . . . . . 0.44 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.528 ' HA ' HG12 ' C' ' 576' ' ' VAL . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 570' ' ' ARG . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.531 ' CE ' ' HB2' ' A' ' 388' ' ' SER . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.644 ' HB2' HG22 ' B' ' 55' ' ' ILE . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' B' ' 78' ' ' PHE . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' B' ' 79' ' ' LEU . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 80' ' ' CYS . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.533 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.432 HG23 HD12 ' B' ' 55' ' ' ILE . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.684 HD13 ' CG1' ' D' ' 388' ' ' VAL . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.524 HG21 ' HD2' ' B' ' 40' ' ' TYR . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.658 ' HG2' ' HE2' ' B' ' 40' ' ' TYR . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.466 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' D' ' 371' ' ' ASN . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.694 ' HB3' HG23 ' D' ' 369' ' ' VAL . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' D' ' 366' ' ' GLN . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.658 ' HE2' ' HG2' ' B' ' 25' ' ' GLN . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.469 ' HB2' HH22 ' B' ' 164' ' ' ARG . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.534 HD22 HD11 ' B' ' 6' ' ' LEU . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.644 HG22 ' HB2' ' B' ' 6' ' ' LEU . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.696 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ASP . . . . . 0.445 ' HA ' ' HE2' ' B' ' 72' ' ' MET . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.696 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' B' ' 69' ' ' ASP . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.437 ' HB2' HG12 ' B' ' 103' ' ' VAL . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.798 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.744 ' HB2' HG12 ' B' ' 8' ' ' VAL . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.45 ' HA ' HG23 ' B' ' 9' ' ' VAL . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.514 HG12 ' HB ' ' B' ' 114' ' ' VAL . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.765 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.533 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.516 HD11 ' HA ' ' B' ' 118' ' ' CYS . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.765 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' ASP . . . . . 0.412 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 89' ' ' SER . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.423 ' O ' HG23 ' B' ' 103' ' ' VAL . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.437 HG12 ' HB2' ' B' ' 73' ' ' ARG . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.798 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.448 HG13 ' HG2' ' B' ' 140' ' ' PRO . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.645 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.514 ' HB ' HG12 ' B' ' 81' ' ' VAL . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.516 ' HA ' HD11 ' B' ' 84' ' ' ILE . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.436 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 121' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.478 ' HA ' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.522 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.514 HG23 ' HE2' ' B' ' 141' ' ' PHE . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.522 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' B' ' 135' ' ' ARG . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.448 ' HG2' HG13 ' B' ' 112' ' ' VAL . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.514 ' HE2' HG23 ' B' ' 127' ' ' THR . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 149' ' ' ARG . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' PHE . . . . . 0.54 ' HE1' HG21 ' B' ' 55' ' ' ILE . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.722 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' B' ' 161' ' ' ARG . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.483 HG22 ' HE2' ' B' ' 167' ' ' LYS . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.469 HH22 ' HB2' ' B' ' 49' ' ' GLU . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.483 ' HE2' HG22 ' B' ' 163' ' ' ILE . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.433 ' HG2' HG22 ' D' ' 369' ' ' VAL . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.719 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.897 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 367' ' ' ARG . . . . . 0.42 ' HG3' ' OG ' ' B' ' 39' ' ' SER . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.694 HG23 ' HB3' ' B' ' 37' ' ' GLU . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.835 ' HB2' HD11 ' B' ' 36' ' ' ILE . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 372' ' ' VAL . . . . . 0.443 HG11 ' SG ' ' D' ' 381' ' ' CYS . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 373' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' D' ' 382' ' ' LEU . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 381' ' ' CYS . . . . . 0.443 ' SG ' HG11 ' D' ' 372' ' ' VAL . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' D' ' 378' ' ' LEU . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.684 ' CG1' HD13 ' B' ' 21' ' ' ILE . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 396' ' ' CYS . . . . . 0.432 ' HB3' HG12 ' D' ' 428' ' ' VAL . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.519 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.519 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 410' ' ' ALA . . . . . 0.43 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.483 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.432 HG12 ' HB3' ' D' ' 396' ' ' CYS . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 451' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.704 ' HA ' HD23 ' D' ' 459' ' ' LEU . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 454' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' D' ' 476' ' ' CYS . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 458' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.781 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.451 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.451 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' D' ' 470' ' ' TYR . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.457 ' CB ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 470' ' ' TYR . . . . . 0.502 ' O ' ' HA ' ' D' ' 464' ' ' ARG . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.781 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.898 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.898 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.47 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.457 ' HB3' ' CB ' ' D' ' 468' ' ' CYS . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 201' ' ' LEU . . . . . 0.56 HD22 HD12 ' A' ' 204' ' ' LEU . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 204' ' ' LEU . . . . . 0.56 HD12 HD22 ' A' ' 201' ' ' LEU . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 206' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 202' ' ' LYS . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 207' ' ' TRP . . . . . 0.468 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 228' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' A' ' 232' ' ' LEU . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.858 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 232' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 243' ' ' MET . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.732 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.461 ' C ' ' HB2' ' A' ' 248' ' ' GLU . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.546 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.732 HD12 ' HG3' ' A' ' 243' ' ' MET . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.461 ' HB2' ' C ' ' A' ' 244' ' ' SER . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.773 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.526 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.773 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.418 ' HG ' HG22 ' A' ' 254' ' ' VAL . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 259' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.408 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.559 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 266' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 270' ' ' GLU . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 266' ' ' GLN . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.624 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 293' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.455 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.525 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.665 HD13 ' HG2' ' C' ' 473' ' ' LYS . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.619 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.514 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 324' ' ' SER . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 330' ' ' ARG . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.553 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.417 ' HG2' ' OD1' ' C' ' 429' ' ' ASN . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 349' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 349' ' ' TYR . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 351' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 353' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 355' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 368' ' ' LEU . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 374' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 378' ' ' VAL . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 378' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 374' ' ' GLY . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.435 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 388' ' ' SER . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.528 ' O ' HG23 ' C' ' 408' ' ' VAL . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.528 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 412' ' ' PHE . . . . . 0.563 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 421' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.417 ' OD1' ' HG2' ' A' ' 345' ' ' ARG . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 433' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 437' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 441' ' ' MET . . . . . 0.47 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.488 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.672 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.87 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.665 ' HG2' HD13 ' A' ' 301' ' ' LEU . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 477' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' C' ' 477' ' ' LEU . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 492' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.431 ' HE3' HD22 ' A' ' 279' ' ' LEU . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.423 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.836 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.836 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.47 HD21 ' HG2' ' A' ' 275' ' ' LYS . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.423 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.673 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.673 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.581 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.559 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.48 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.413 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.473 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.665 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.473 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.665 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 518' ' ' LEU . . . . . 0.428 ' HG ' HD22 ' C' ' 514' ' ' LEU . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.65 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.578 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' C' ' 528' ' ' ARG . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.578 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 529' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 538' ' ' GLU . . . . . 0.402 ' HA ' ' OE2' ' C' ' 538' ' ' GLU . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.628 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' C' ' 577' ' ' LEU . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.812 HD22 ' HE3' ' C' ' 581' ' ' LYS . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.403 ' O ' HG23 ' C' ' 582' ' ' VAL . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 581' ' ' LYS . . . . . 0.812 ' HE3' HD22 ' C' ' 577' ' ' LEU . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.403 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 590' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' C' ' 593' ' ' LYS . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' C' ' 590' ' ' GLU . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.435 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' B' ' 55' ' ' ILE . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.419 HG11 HD11 ' B' ' 100' ' ' ILE . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' D' ' 370' ' ' VAL . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.847 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 41' ' ' ARG . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' D' ' 468' ' ' CYS . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.407 HD13 HG11 ' B' ' 160' ' ' VAL . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.481 HD22 HD11 ' B' ' 6' ' ' LEU . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' B' ' 6' ' ' LEU . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.599 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.622 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.622 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.744 ' HE3' HG21 ' B' ' 103' ' ' VAL . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.857 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.796 ' HG ' HD22 ' B' ' 159' ' ' LEU . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.481 ' HB2' HD12 ' B' ' 113' ' ' LEU . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.589 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.477 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.897 HD11 ' HA ' ' B' ' 118' ' ' CYS . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.578 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.419 HD11 HG11 ' B' ' 9' ' ' VAL . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.744 HG21 ' HE3' ' B' ' 72' ' ' MET . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.857 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.682 ' HB ' HD23 ' B' ' 79' ' ' LEU . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 80' ' ' CYS . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.457 HG22 ' HB ' ' B' ' 142' ' ' ILE . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.633 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.897 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.633 HD12 ' HB3' ' B' ' 117' ' ' LYS . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.517 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.733 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.733 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.566 ' HG2' HG13 ' B' ' 112' ' ' VAL . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' B' ' 114' ' ' VAL . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ASP . . . . . 0.406 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.406 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.796 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.407 HG11 HD13 ' B' ' 46' ' ' ILE . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 161' ' ' ARG . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.606 HG22 ' HE2' ' B' ' 167' ' ' LYS . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.606 ' HE2' HG22 ' B' ' 163' ' ' ILE . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' D' D ' 357' ' ' THR . . . . . 0.477 ' H ' HG13 ' D' ' 422' ' ' ILE . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.571 ' HD3' ' HE1' ' D' ' 361' ' ' PHE . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 360' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' D' ' 368' ' ' THR . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 361' ' ' PHE . . . . . 0.571 ' HE1' ' HD3' ' D' ' 359' ' ' ARG . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.988 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.583 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.988 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 367' ' ' ARG . . . . . 0.487 ' HB3' ' CE2' ' D' ' 361' ' ' PHE . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.477 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.847 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 370' ' ' VAL . . . . . 0.705 ' HA ' HD12 ' B' ' 36' ' ' ILE . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 372' ' ' VAL . . . . . 0.53 HG11 ' SG ' ' D' ' 381' ' ' CYS . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 381' ' ' CYS . . . . . 0.53 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 386' ' ' LEU . . . . . 0.648 HD21 ' HD3' ' D' ' 393' ' ' PRO . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 387' ' ' LYS . . . . . 0.463 ' HB2' ' HE3' ' D' ' 387' ' ' LYS . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 389' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 389' ' ' ARG . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 393' ' ' PRO . . . . . 0.648 ' HD3' HD21 ' D' ' 386' ' ' LEU . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 396' ' ' CYS . . . . . 0.497 ' HB3' HG12 ' D' ' 428' ' ' VAL . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 397' ' ' ALA . . . . . 0.688 ' HB2' HD23 ' D' ' 431' ' ' LEU . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 401' ' ' LEU . . . . . 0.401 HD13 ' HB2' ' D' ' 425' ' ' GLU . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 411' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' D' ' 411' ' ' ARG . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' D' ' 412' ' ' LEU . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 422' ' ' ILE . . . . . 0.477 HG13 ' H ' ' D' ' 357' ' ' THR . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.401 ' HB2' HD13 ' D' ' 401' ' ' LEU . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 428' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' D' ' 396' ' ' CYS . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' D' ' 397' ' ' ALA . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' D' ' 484' ' ' CYS . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 440' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' D' ' 465' ' ' CYS . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 442' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 444' ' ' LYS . . . . . 0.578 ' HG2' ' HD3' ' D' ' 464' ' ' ARG . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 445' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' D' ' 444' ' ' LYS . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 446' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' D' ' 464' ' ' ARG . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.417 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 463' ' ' PHE . . . . . 0.572 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.578 ' HD3' ' HG2' ' D' ' 444' ' ' LYS . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' D' D ' 469' ' ' GLY . . . . . 0.435 ' H ' ' HB2' ' D' ' 465' ' ' CYS . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.409 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.877 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 474' ' ' GLU . . . . . 0.572 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.877 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.519 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.445 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 481' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 206' ' ' ASN . . . . . 0.45 ' HA ' HD22 ' A' ' 206' ' ' ASN . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 220' ' ' GLN . . . . . 0.418 HE22 ' CD ' ' C' ' 553' ' ' GLU . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 221' ' ' LEU . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 224' ' ' VAL . . . . . 0.441 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 225' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 232' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 245' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.585 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.469 ' HA ' HG12 ' A' ' 250' ' ' VAL . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 249' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.723 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.723 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.445 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.445 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.456 ' O ' ' HD2' ' A' ' 261' ' ' PHE . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 258' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 254' ' ' VAL . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 257' ' ' TYR . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 262' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 266' ' ' GLN . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.481 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.683 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 266' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 262' ' ' GLN . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.514 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.536 ' HA ' HG12 ' A' ' 276' ' ' VAL . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.71 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.422 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 280' ' ' ARG . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 288' ' ' ARG . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 291' ' ' LEU . . . . . 0.423 HD23 HD12 ' A' ' 294' ' ' LEU . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.423 HD12 HD23 ' A' ' 291' ' ' LEU . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.596 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.558 HD13 ' HG2' ' C' ' 473' ' ' LYS . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.577 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 308' ' ' ARG . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.577 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.622 ' HA ' HD12 ' A' ' 316' ' ' LEU . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.487 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.584 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 326' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.584 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.51 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 346' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 352' ' ' LYS . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.612 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.805 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.805 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.428 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 378' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 382' ' ' PHE . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 384' ' ' VAL . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 382' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 378' ' ' VAL . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 380' ' ' GLU . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.546 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 399' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' C' ' 399' ' ' LEU . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 403' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 406' ' ' ASP . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 406' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 403' ' ' ASP . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.518 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 411' ' ' THR . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.45 ' HA ' ' HG2' ' C' ' 425' ' ' GLU . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' C' ' 422' ' ' VAL . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.638 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 441' ' ' MET . . . . . 0.638 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 442' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' C' ' 446' ' ' GLU . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.442 ' O ' HG12 ' C' ' 448' ' ' VAL . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 446' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' C' ' 442' ' ' SER . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.442 HG12 ' O ' ' C' ' 445' ' ' LEU . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 449' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.416 HG23 HG22 ' C' ' 448' ' ' VAL . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.751 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.751 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.523 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 460' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' C' ' 460' ' ' GLN . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.558 ' HG2' HD13 ' A' ' 301' ' ' LEU . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 483' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' C' ' 486' ' ' ARG . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 486' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' C' ' 483' ' ' GLU . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 488' ' ' LYS . . . . . 0.433 ' HA ' ' OE1' ' C' ' 491' ' ' GLU . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' C' ' 488' ' ' LYS . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.697 ' HE3' HD22 ' A' ' 279' ' ' LEU . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.478 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.419 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.684 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.684 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.683 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.634 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.426 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.856 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 513' ' ' ALA . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.856 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.419 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.647 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.447 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 524' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' C' ' 522' ' ' SER . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.585 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.549 HD23 HD12 ' C' ' 536' ' ' LEU . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.436 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.549 HD12 HD23 ' C' ' 533' ' ' LEU . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' C' ' 544' ' ' LEU . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.601 ' HA ' ' HB2' ' C' ' 546' ' ' GLU . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' C' ' 540' ' ' GLY . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' C' ' 543' ' ' ARG . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.418 ' CD ' HE22 ' A' ' 220' ' ' GLN . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' C' ' 558' ' ' LEU . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 559' ' ' SER . . . . . 0.474 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 562' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 568' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 575' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' C' ' 577' ' ' LEU . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 580' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.704 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.521 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' B' ' 79' ' ' LEU . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.423 HG21 HD11 ' B' ' 100' ' ' ILE . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HG3' ' B' ' 61' ' ' GLN . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.4 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.429 HG22 ' HD1' ' B' ' 40' ' ' TYR . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.805 HD13 HG13 ' D' ' 388' ' ' VAL . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.593 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.661 HD11 ' HB2' ' D' ' 371' ' ' ASN . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.652 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' B' ' 20' ' ' THR . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.416 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' CYS . . . . . 0.416 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.644 HD11 ' HG3' ' B' ' 37' ' ' GLU . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.4 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' HA3' ' B' ' 12' ' ' GLY . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' B' ' 68' ' ' ARG . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.554 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.825 ' HG ' HD22 ' B' ' 159' ' ' LEU . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.405 ' HB2' HD12 ' B' ' 113' ' ' LEU . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.749 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.542 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.975 HD11 ' HA ' ' B' ' 118' ' ' CYS . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.542 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.749 HD11 ' HB3' ' B' ' 82' ' ' PHE . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.515 ' O ' HG23 ' B' ' 103' ' ' VAL . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.423 HD11 HG21 ' B' ' 9' ' ' VAL . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' B' ' 107' ' ' GLU . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 99' ' ' GLN . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' GLU . . . . . 0.468 ' HA ' ' HE3' ' B' ' 101' ' ' LYS . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.554 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.683 ' HB ' HD23 ' B' ' 79' ' ' LEU . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 80' ' ' CYS . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.592 ' HB ' HG12 ' B' ' 81' ' ' VAL . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 144' ' ' THR . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' B' ' 120' ' ' LEU . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.975 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' B' ' 117' ' ' LYS . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.517 ' HG3' HD12 ' B' ' 84' ' ' ILE . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.693 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.43 HG23 ' HE2' ' B' ' 141' ' ' PHE . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.693 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.43 ' HE2' HG23 ' B' ' 127' ' ' THR . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.593 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ASP . . . . . 0.439 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.461 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.825 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' B' ' 157' ' ' TYR . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.436 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 165' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' B' ' 161' ' ' ARG . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 168' ' ' GLU . . . . . 0.808 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 172' ' ' LYS . . . . . 0.808 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 38.0 mtmt . . . . . 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' D' ' 425' ' ' GLU . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 361' ' ' PHE . . . . . 0.411 ' HB3' ' HG3' ' D' ' 427' ' ' GLN . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.813 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.599 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.813 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 367' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 367' ' ' ARG . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.652 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.661 ' HB2' HD11 ' B' ' 36' ' ' ILE . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 373' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 373' ' ' ARG . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.488 HD12 ' HB ' ' D' ' 416' ' ' THR . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 382' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' D' ' 386' ' ' LEU . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 386' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' D' ' 382' ' ' LEU . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.805 HG13 HD13 ' B' ' 21' ' ' ILE . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 389' ' ' ARG . . . . . 0.529 ' NH2' ' HG2' ' D' ' 366' ' ' GLN . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 395' ' ' CYS . . . . . 0.462 ' HA ' ' CD2' ' D' ' 431' ' ' LEU . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.567 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.641 ' HA ' ' HG ' ' D' ' 426' ' ' LEU . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 401' ' ' LEU . . . . . 0.601 HD13 ' HG3' ' D' ' 425' ' ' GLU . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.418 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.567 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 410' ' ' ALA . . . . . 0.457 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' D' ' 412' ' ' LEU . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.488 ' HB ' HD12 ' D' ' 378' ' ' LEU . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 424' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' D' ' 401' ' ' LEU . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' D' ' 400' ' ' ARG . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 427' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' D' ' 361' ' ' PHE . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.462 ' CD2' ' HA ' ' D' ' 395' ' ' CYS . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 451' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.801 ' HA ' HD23 ' D' ' 459' ' ' LEU . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 455' ' ' CYS . . . . . 0.407 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 458' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.523 ' HG ' ' HG ' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.523 ' HG ' ' HG ' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.808 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.748 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 473' ' ' HIS . . . . . 0.477 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.748 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.695 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 206' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 210' ' ' VAL . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 210' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 206' ' ' ASN . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 218' ' ' ARG . . . . . 0.402 ' HA ' HD12 ' A' ' 221' ' ' LEU . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 218' ' ' ARG . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HE3' ' HA ' ' A' ' 229' ' ' TRP . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.797 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 232' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 232' ' ' LEU . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.416 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.797 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.471 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.936 ' HG3' HD12 ' A' ' 247' ' ' LEU . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 244' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 248' ' ' GLU . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.451 ' O ' ' HB ' ' A' ' 250' ' ' VAL . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.936 HD12 ' HG3' ' A' ' 243' ' ' MET . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 248' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' A' ' 244' ' ' SER . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.713 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.433 ' O ' HG12 ' A' ' 254' ' ' VAL . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.552 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 257' ' ' TYR . . . . . 0.42 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 261' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 263' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.553 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.453 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 270' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.585 ' HA ' HG12 ' A' ' 276' ' ' VAL . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 274' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.723 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 273' ' ' ARG . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.764 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.764 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.799 HD22 ' HE3' ' C' ' 495' ' ' LYS . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 290' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.769 HD13 ' HG2' ' C' ' 473' ' ' LYS . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 305' ' ' MET . . . . . 0.43 ' SD ' HD13 ' C' ' 469' ' ' LEU . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.559 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 308' ' ' ARG . . . . . 0.671 ' HG3' HD21 ' C' ' 469' ' ' LEU . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 313' ' ' VAL . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 313' ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' ' 316' ' ' LEU . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 314' ' ' ASP . . . . . 0.411 ' HA ' ' NH1' ' A' ' 317' ' ' ARG . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.459 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 314' ' ' ASP . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 327' ' ' LEU . . . . . 0.429 HD23 ' HD2' ' A' ' 330' ' ' ARG . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.78 HH21 ' HB3' ' C' ' 447' ' ' GLU . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 338' ' ' LEU . . . . . 0.412 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 342' ' ' GLY . . . . . 0.412 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 343' ' ' GLY . . . . . 0.407 ' HA2' HD12 ' A' ' 346' ' ' LEU . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 346' ' ' LEU . . . . . 0.407 HD12 ' HA2' ' A' ' 343' ' ' GLY . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.748 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.748 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 357' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 357' ' ' LEU . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 359' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' C' ' 414' ' ' LYS . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 361' ' ' SER . . . . . 0.656 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.402 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.981 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.981 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 368' ' ' LEU . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 375' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 379' ' ' LEU . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 377' ' ' PRO . . . . . 0.467 ' HG2' ' HE3' ' C' ' 400' ' ' LYS . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 379' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 376' ' ' LEU . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 383' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 386' ' ' PHE . . . . . 0.621 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.659 ' HB2' ' HE3' ' C' ' 594' ' ' LYS . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 389' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 393' ' ' TYR . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 392' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 388' ' ' SER . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 393' ' ' TYR . . . . . 0.458 ' HD2' ' O ' ' A' ' 389' ' ' ALA . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 395' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 400' ' ' LYS . . . . . 0.467 ' HE3' ' HG2' ' A' ' 377' ' ' PRO . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 402' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 405' ' ' TRP . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.41 ' O ' HG23 ' C' ' 408' ' ' VAL . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 405' ' ' TRP . . . . . 0.447 ' HB2' ' HA ' ' C' ' 402' ' ' LEU . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 413' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.513 ' HB3' ' CG2' ' A' ' 359' ' ' THR . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 417' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' C' ' 413' ' ' SER . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.436 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.741 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.463 ' O ' HG12 ' C' ' 448' ' ' VAL . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.78 ' HB3' HH21 ' A' ' 330' ' ' ARG . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.769 HG22 HG23 ' C' ' 452' ' ' VAL . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 449' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.769 HG23 HG22 ' C' ' 448' ' ' VAL . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 458' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' C' ' 458' ' ' ASP . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 463' ' ' TRP . . . . . 0.435 ' O ' ' HB2' ' C' ' 467' ' ' MET . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 464' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 467' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 468' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.618 ' HA ' ' HG2' ' C' ' 475' ' ' GLU . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.769 ' HG2' HD13 ' A' ' 301' ' ' LEU . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.618 ' HG2' ' HA ' ' C' ' 471' ' ' ARG . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.68 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 482' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 487' ' ' GLN . . . . . 0.501 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 491' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.799 ' HE3' HD22 ' A' ' 279' ' ' LEU . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' C' ' 501' ' ' GLU . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 501' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' C' ' 497' ' ' SER . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.567 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.461 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.553 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.571 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.805 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.805 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.692 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.48 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 533' ' ' LEU . . . . . 0.67 HD23 HD12 ' C' ' 536' ' ' LEU . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.67 HD12 HD23 ' C' ' 533' ' ' LEU . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.513 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 542' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 546' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' C' ' 542' ' ' ALA . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 568' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' C' ' 576' ' ' VAL . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.444 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 578' ' ' GLU . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 591' ' ' TYR . . . . . 0.451 ' HD1' ' HA ' ' C' ' 591' ' ' TYR . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.659 ' HE3' ' HB2' ' A' ' 388' ' ' SER . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.486 ' HB ' ' HE2' ' B' ' 4' ' ' TYR . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.697 ' HG3' HD22 ' B' ' 52' ' ' LEU . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' TYR . . . . . 0.486 ' HE2' ' HB ' ' B' ' 2' ' ' THR . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.602 HD22 HD23 ' B' ' 159' ' ' LEU . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.463 HG11 ' HG3' ' B' ' 72' ' ' MET . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' VAL . . . . . 0.436 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.474 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.601 HD13 ' CG1' ' D' ' 388' ' ' VAL . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.533 HD22 HG12 ' B' ' 152' ' ' VAL . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ILE . . . . . 0.416 HD12 ' HB2' ' B' ' 42' ' ' LYS . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' HIS . . . . . 0.454 ' O ' HG22 ' B' ' 21' ' ' ILE . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PHE . . . . . 0.437 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.784 ' HB2' ' CG2' ' D' ' 369' ' ' VAL . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LYS . . . . . 0.416 ' HB2' HD12 ' B' ' 24' ' ' ILE . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.56 ' HA ' ' HD2' ' D' ' 448' ' ' LYS . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' GLY . . . . . 0.611 ' HA2' ' CB ' ' D' ' 450' ' ' ALA . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 49' ' ' GLU . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.697 HD22 ' HG3' ' B' ' 3' ' ' GLU . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.542 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.463 ' HG3' HG11 ' B' ' 7' ' ' VAL . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.622 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.548 ' HG ' HD22 ' B' ' 159' ' ' LEU . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.412 ' HB2' HD12 ' B' ' 113' ' ' LEU . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' B' ' 93' ' ' ILE . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.543 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.994 HD11 ' HA ' ' B' ' 118' ' ' CYS . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.543 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' ASN . . . . . 0.489 HD21 ' HB3' ' B' ' 88' ' ' LYS . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LYS . . . . . 0.489 ' HB3' HD21 ' B' ' 86' ' ' ASN . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.779 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 101' ' ' LYS . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.439 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.597 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 144' ' ' THR . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.442 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.994 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.424 HD12 ' HB3' ' B' ' 117' ' ' LYS . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 122' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' THR . . . . . 0.486 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 141' ' ' PHE . . . . . 0.486 ' HE2' HG23 ' B' ' 127' ' ' THR . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.511 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' VAL . . . . . 0.533 HG12 HD22 ' B' ' 23' ' ' LEU . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.426 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.602 HD23 HD22 ' B' ' 6' ' ' LEU . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' B' ' 161' ' ' ARG . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 164' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 164' ' ' ARG . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' HIS . . . . . 0.435 ' O ' ' HG2' ' B' ' 170' ' ' MET . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 170' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 166' ' ' HIS . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 172' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' B' ' 172' ' ' LYS . 34.7 mtmt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 356' ' ' ASN . . . . . 0.474 ' HA ' HD12 ' D' ' 422' ' ' ILE . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 357' ' ' THR . . . . . 0.461 ' H ' HG13 ' D' ' 422' ' ' ILE . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.827 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.827 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 367' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 367' ' ' ARG . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.784 ' CG2' ' HB2' ' B' ' 37' ' ' GLU . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' D' ' 416' ' ' THR . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 379' ' ' HIS . . . . . 0.642 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.601 ' CG1' HD13 ' B' ' 21' ' ' ILE . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 389' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 391' ' ' LEU . . . . . 0.508 HD13 ' HZ ' ' D' ' 430' ' ' PHE . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 397' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 398' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' D' ' 411' ' ' ARG . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.497 ' CE2' ' HB3' ' D' ' 429' ' ' ASP . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 401' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' D' ' 425' ' ' GLU . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.527 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.439 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 411' ' ' ARG . . . . . 0.445 ' HD3' ' HB1' ' D' ' 397' ' ' ALA . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 414' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.504 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 422' ' ' ILE . . . . . 0.474 HD12 ' HA ' ' D' ' 356' ' ' ASN . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.525 ' HB2' HD13 ' D' ' 401' ' ' LEU . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.49 HD22 HD22 ' D' ' 378' ' ' LEU . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 429' ' ' ASP . . . . . 0.497 ' HB3' ' CE2' ' D' ' 399' ' ' PHE . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 430' ' ' PHE . . . . . 0.52 ' HE2' ' HG3' ' D' ' 363' ' ' PRO . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 431' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 436' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' D' ' 436' ' ' LEU . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 442' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 446' ' ' PHE . . . . . 0.447 ' CZ ' HD12 ' D' ' 459' ' ' LEU . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 448' ' ' LYS . . . . . 0.56 ' HD2' ' HA ' ' B' ' 47' ' ' ASP . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 450' ' ' ALA . . . . . 0.611 ' CB ' ' HA2' ' B' ' 48' ' ' GLY . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.503 ' CA ' HD23 ' D' ' 459' ' ' LEU . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 454' ' ' ILE . . . . . 0.485 HD11 ' HE2' ' D' ' 470' ' ' TYR . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.503 HD23 ' CA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' D' ' 442' ' ' ALA . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 470' ' ' TYR . . . . . 0.485 ' HE2' HD11 ' D' ' 454' ' ' ILE . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.4 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.903 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.563 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.441 HG12 ' O ' ' D' ' 476' ' ' CYS . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 203' ' ' LEU . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 215' ' ' SER . . . . . 0.406 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 215' ' ' SER . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 225' ' ' THR . . . . . 0.546 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 228' ' ' PHE . . . . . 0.459 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 229' ' ' TRP . . . . . 0.594 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.762 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 232' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.762 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.649 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.565 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.649 HD12 ' HG3' ' A' ' 243' ' ' MET . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.706 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.706 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.465 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.427 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 267' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 271' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.545 ' HA ' HG12 ' A' ' 276' ' ' VAL . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.667 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 273' ' ' ARG . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.491 ' HA ' HD12 ' A' ' 283' ' ' LEU . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 281' ' ' ALA . . . . . 0.547 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 282' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 283' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 280' ' ' ARG . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 285' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 294' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.493 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.502 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 307' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 310' ' ' ARG . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 307' ' ' ASP . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 316' ' ' LEU . . . . . 0.408 HD21 ' HE3' ' C' ' 462' ' ' LYS . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 320' ' ' LEU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.445 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 323' ' ' TYR . . . . . 0.46 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 329' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 330' ' ' ARG . . . . . 0.628 HH21 ' HB3' ' C' ' 447' ' ' GLU . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 334' ' ' ARG . . . . . 0.416 ' HD3' HH11 ' A' ' 334' ' ' ARG . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.482 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 360' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 363' ' ' LYS . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.462 ' HG3' ' HE3' ' C' ' 414' ' ' LYS . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.683 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.918 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.918 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 371' ' ' LEU . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 369' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 371' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 368' ' ' LEU . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.413 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.443 ' O ' HG23 ' A' ' 384' ' ' VAL . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 380' ' ' GLU . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 396' ' ' LYS . . . . . 0.584 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 404' ' ' ASN . . . . . 0.473 ' O ' HG23 ' C' ' 408' ' ' VAL . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 408' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 404' ' ' ASN . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.462 ' HE3' ' HG3' ' A' ' 362' ' ' GLU . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' C' ' 419' ' ' LEU . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 419' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' C' ' 416' ' ' ARG . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.482 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.597 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 445' ' ' LEU . . . . . 0.454 ' O ' HG12 ' C' ' 448' ' ' VAL . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.628 ' HB3' HH21 ' A' ' 330' ' ' ARG . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.597 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 449' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.454 HG23 ' O ' ' C' ' 448' ' ' VAL . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 453' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 462' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 464' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 466' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' C' ' 462' ' ' LYS . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 468' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.888 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.484 ' NZ ' HD22 ' C' ' 469' ' ' LEU . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.888 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 476' ' ' PRO . . . . . 0.675 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 489' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 493' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.566 ' HA ' HD13 ' C' ' 499' ' ' LEU . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.478 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' C' ' 495' ' ' LYS . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 501' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 497' ' ' SER . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.649 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.584 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.546 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.649 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.546 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.427 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 510' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.452 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.509 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 517' ' ' HIS . . . . . 0.473 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.711 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 521' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 522' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 523' ' ' ASP . . . . . 0.804 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 526' ' ' ARG . . . . . 0.804 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.565 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 529' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 532' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.785 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 535' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 537' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 539' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 543' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 549' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 553' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 6.9 t-80 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 555' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' C' ' 558' ' ' LEU . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 558' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' C' ' 555' ' ' LEU . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 561' ' ' LYS . . . . . 0.531 ' HB2' ' HZ2' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 566' ' ' LEU . . . . . 0.407 HD23 HD12 ' C' ' 569' ' ' LEU . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 569' ' ' LEU . . . . . 0.407 HD12 HD23 ' C' ' 566' ' ' LEU . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 573' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' C' ' 577' ' ' LEU . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 574' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' C' ' 578' ' ' GLU . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 577' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 587' ' ' ALA . . . . . 0.584 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 589' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 593' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.49 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.744 HD23 ' HB2' ' B' ' 146' ' ' ALA . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.515 HD13 HG13 ' D' ' 388' ' ' VAL . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.676 HD11 ' HB2' ' D' ' 371' ' ' ASN . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.787 ' HB3' HG23 ' D' ' 369' ' ' VAL . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' VAL . . . . . 0.55 HG12 HH22 ' D' ' 464' ' ' ARG . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.655 HG21 HG21 ' B' ' 160' ' ' VAL . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.481 ' H ' ' HE1' ' B' ' 157' ' ' TYR . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.49 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.499 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLU . . . . . 0.429 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.642 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.642 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.457 ' HE3' HG21 ' B' ' 103' ' ' VAL . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.482 ' HB2' ' HG3' ' B' ' 111' ' ' MET . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' B' ' 112' ' ' VAL . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' B' ' 113' ' ' LEU . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.8 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.437 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.643 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.437 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.704 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.8 HD11 ' HB3' ' B' ' 82' ' ' PHE . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' ARG . . . . . 0.415 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.415 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.457 HG21 ' HE3' ' B' ' 72' ' ' MET . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.482 ' HG3' ' HB2' ' B' ' 78' ' ' PHE . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 112' ' ' VAL . . . . . 0.607 HG22 ' HG2' ' B' ' 140' ' ' PRO . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 80' ' ' CYS . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 142' ' ' ILE . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.452 ' HA ' HD11 ' B' ' 84' ' ' ILE . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD13 ' B' ' 84' ' ' ILE . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.471 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' PRO . . . . . 0.607 ' HG2' HG22 ' B' ' 112' ' ' VAL . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' B' ' 114' ' ' VAL . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' ALA . . . . . 0.744 ' HB2' HD23 ' B' ' 19' ' ' LEU . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ASP . . . . . 0.705 ' HA ' ' HD2' ' B' ' 157' ' ' TYR . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 157' ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' B' ' 154' ' ' ASP . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 159' ' ' LEU . . . . . 0.445 ' O ' HG13 ' B' ' 163' ' ' ILE . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 160' ' ' VAL . . . . . 0.655 HG21 HG21 ' B' ' 46' ' ' ILE . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt . . . . . 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.502 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 362' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 363' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 366' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 368' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.676 ' HB2' HD11 ' B' ' 36' ' ' ILE . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.681 HD21 HD12 ' D' ' 421' ' ' LEU . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 379' ' ' HIS . . . . . 0.524 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.515 HG13 HD13 ' B' ' 21' ' ' ILE . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 391' ' ' LEU . . . . . 0.471 ' CD2' ' HZ ' ' D' ' 430' ' ' PHE . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' D' ' 412' ' ' LEU . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 402' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' D' ' 409' ' ' LYS . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 405' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 408' ' ' LYS . . . . . 0.454 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 409' ' ' LYS . . . . . 0.748 ' HA ' HD11 ' D' ' 402' ' ' LEU . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 411' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 411' ' ' ARG . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 412' ' ' LEU . . . . . 0.567 HD12 ' HB3' ' D' ' 400' ' ' ARG . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 413' ' ' ASP . . . . . 0.448 ' O ' HD12 ' D' ' 378' ' ' LEU . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 414' ' ' TRP . . . . . 0.524 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 421' ' ' LEU . . . . . 0.681 HD12 HD21 ' D' ' 378' ' ' LEU . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 424' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.502 ' HG2' ' HD2' ' D' ' 359' ' ' ARG . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.555 HD22 HD22 ' D' ' 378' ' ' LEU . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 430' ' ' PHE . . . . . 0.471 ' HZ ' ' CD2' ' D' ' 391' ' ' LEU . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 436' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 439' ' ' HIS . . . . . 0.446 ' CE1' ' HB3' ' D' ' 465' ' ' CYS . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 441' ' ' PHE . . . . . 0.515 ' HZ ' ' HB3' ' D' ' 477' ' ' SER . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 443' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 443' ' ' ARG . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 444' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' D' ' 444' ' ' LYS . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 451' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 452' ' ' CYS . . . . . 0.614 ' HA ' HD23 ' D' ' 459' ' ' LEU . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 454' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' D' ' 476' ' ' CYS . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 455' ' ' CYS . . . . . 0.402 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 458' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 459' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.487 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.487 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 463' ' ' PHE . . . . . 0.464 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 464' ' ' ARG . . . . . 0.55 HH22 HG12 ' B' ' 44' ' ' VAL . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.446 ' HB3' ' CE1' ' D' ' 439' ' ' HIS . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 468' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.721 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 473' ' ' HIS . . . . . 0.404 ' CE1' ' HB2' ' D' ' 452' ' ' CYS . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 474' ' ' GLU . . . . . 0.464 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 475' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' D' ' 479' ' ' LYS . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.721 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 477' ' ' SER . . . . . 0.515 ' HB3' ' HZ ' ' D' ' 441' ' ' PHE . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 479' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.486 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 481' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 484' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 213' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 215' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 217' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 213' ' ' THR . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 219' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 215' ' ' SER . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 221' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 231' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 233' ' ' GLU . . . . . 0.622 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 234' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 236' ' ' THR . . . . . 0.622 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 237' ' ' GLU . . . . . 0.576 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 239' ' ' LEU . . . . . 0.493 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 240' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 242' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 243' ' ' MET . . . . . 0.683 ' HG3' HD12 ' A' ' 247' ' ' LEU . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 246' ' ' ASP . . . . . 0.708 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 247' ' ' LEU . . . . . 0.683 HD12 ' HG3' ' A' ' 243' ' ' MET . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 250' ' ' VAL . . . . . 0.574 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 254' ' ' VAL . . . . . 0.574 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 255' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 256' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 264' ' ' LYS . . . . . 0.659 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 265' ' ' TRP . . . . . 0.408 ' O ' ' HG2' ' A' ' 269' ' ' MET . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 269' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 265' ' ' TRP . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 272' ' ' TYR . . . . . 0.403 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 273' ' ' ARG . . . . . 0.553 ' HA ' HG12 ' A' ' 276' ' ' VAL . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 275' ' ' LYS . . . . . 0.601 ' HG2' HD21 ' C' ' 499' ' ' LEU . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 276' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 273' ' ' ARG . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 277' ' ' GLU . . . . . 0.42 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 278' ' ' PRO . . . . . 0.42 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 279' ' ' LEU . . . . . 0.842 HD22 ' HE3' ' C' ' 495' ' ' LYS . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 280' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 288' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 288' ' ' ARG . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 297' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 298' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 299' ' ' SER . . . . . 0.515 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 300' ' ' PRO . . . . . 0.515 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 301' ' ' LEU . . . . . 0.489 HD13 ' HG2' ' C' ' 473' ' ' LYS . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 302' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 303' ' ' GLU . . . . . 0.435 ' HG2' ' NH1' ' A' ' 306' ' ' ARG . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 306' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 310' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 312' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 317' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 317' ' ' ARG . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 321' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 322' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 324' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 325' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 328' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 332' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 335' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 336' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 339' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 348' ' ' GLU . . . . . 0.505 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 352' ' ' LYS . . . . . 0.406 ' HG3' ' OE2' ' C' ' 425' ' ' GLU . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 363' ' ' LYS . . . . . 0.77 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 367' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 368' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.578 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 376' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 380' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 384' ' ' VAL . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 384' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 380' ' ' GLU . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 388' ' ' SER . . . . . 0.625 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 390' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 390' ' ' LEU . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 411' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 414' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 415' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' C' ' 411' ' ' THR . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 416' ' ' ARG . . . . . 0.46 HH11 ' HD2' ' C' ' 416' ' ' ARG . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 425' ' ' GLU . . . . . 0.406 ' OE2' ' HG3' ' A' ' 352' ' ' LYS . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 426' ' ' PHE . . . . . 0.581 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 427' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 428' ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 429' ' ' ASN . . . . . 0.505 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 430' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 431' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 432' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 435' ' ' GLU . . . . . 0.43 ' HA ' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 438' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' C' ' 435' ' ' GLU . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 439' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 440' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 443' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 444' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 447' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' C' ' 443' ' ' LYS . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 448' ' ' VAL . . . . . 0.451 HG23 ' O ' ' C' ' 444' ' ' ASP . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 451' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 452' ' ' VAL . . . . . 0.422 HG23 HG13 ' C' ' 448' ' ' VAL . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 454' ' ' PRO . . . . . 0.445 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 455' ' ' TYR . . . . . 0.615 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 457' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 461' ' ' LYS . . . . . 0.652 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 465' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 469' ' ' LEU . . . . . 0.621 HD22 ' HZ3' ' C' ' 473' ' ' LYS . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 471' ' ' ARG . . . . . 0.763 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 473' ' ' LYS . . . . . 0.621 ' HZ3' HD22 ' C' ' 469' ' ' LEU . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 475' ' ' GLU . . . . . 0.763 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 478' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' C' ' 478' ' ' ARG . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 495' ' ' LYS . . . . . 0.842 ' HE3' HD22 ' A' ' 279' ' ' LEU . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 496' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 497' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 498' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 499' ' ' LEU . . . . . 0.601 HD21 ' HG2' ' A' ' 275' ' ' LYS . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 500' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 501' ' ' GLU . . . . . 0.523 ' HA ' ' HD2' ' C' ' 504' ' ' ARG . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 502' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 503' ' ' MET . . . . . 0.475 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 504' ' ' ARG . . . . . 0.523 ' HD2' ' HA ' ' C' ' 501' ' ' GLU . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 505' ' ' ASP . . . . . 0.422 ' OD1' ' HD2' ' C' ' 508' ' ' ARG . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 506' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 508' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 509' ' ' ALA . . . . . 0.659 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 511' ' ' VAL . . . . . 0.617 ' HA ' HD12 ' C' ' 514' ' ' LEU . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 512' ' ' ASP . . . . . 0.738 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 514' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' C' ' 511' ' ' VAL . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 515' ' ' ARG . . . . . 0.738 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 519' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 520' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 525' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 528' ' ' ARG . . . . . 0.708 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 529' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 530' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 534' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 536' ' ' LEU . . . . . 0.435 ' O ' ' HA3' ' C' ' 540' ' ' GLY . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 540' ' ' GLY . . . . . 0.499 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 544' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 550' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 554' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 564' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 568' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 572' ' ' GLY . . . . . 0.509 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 576' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' C' ' 572' ' ' GLY . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 578' ' ' GLU . . . . . 0.497 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 582' ' ' VAL . . . . . 0.497 HG23 ' O ' ' C' ' 578' ' ' GLU . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 585' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' C' ' 585' ' ' LEU . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 594' ' ' LYS . . . . . 0.625 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.603 ' HA ' ' HB ' ' B' ' 50' ' ' THR . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 3' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.472 HD11 HD22 ' B' ' 53' ' ' LEU . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' VAL . . . . . 0.672 HG12 ' HB2' ' B' ' 79' ' ' LEU . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.42 HG21 HD11 ' B' ' 100' ' ' ILE . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.656 HG21 ' HB ' ' D' ' 388' ' ' VAL . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.767 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' B' ' 153' ' ' ASP . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' VAL . . . . . 0.508 HG12 HG11 ' D' ' 388' ' ' VAL . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' THR . . . . . 0.56 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.802 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ARG . . . . . 0.527 HH11 HD11 ' B' ' 52' ' ' LEU . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ILE . . . . . 0.715 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' B' ' 1' ' ' MET . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' CYS . . . . . 0.715 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' LEU . . . . . 0.638 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.472 HD22 HD11 ' B' ' 6' ' ' LEU . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ALA . . . . . 0.63 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' TYR . . . . . 0.451 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.626 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' TYR . . . . . 0.626 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' MET . . . . . 0.448 ' CE ' HG21 ' B' ' 103' ' ' VAL . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' B' ' 73' ' ' ARG . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' B' ' 111' ' ' MET . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.672 ' HB2' HG12 ' B' ' 8' ' ' VAL . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' CYS . . . . . 0.408 ' HB3' HD12 ' B' ' 93' ' ' ILE . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.633 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' PHE . . . . . 0.71 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ALA . . . . . 0.475 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' B' ' 118' ' ' CYS . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ASN . . . . . 0.475 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' SER . . . . . 0.71 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' ILE . . . . . 0.512 HD11 ' HB3' ' B' ' 82' ' ' PHE . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 99' ' ' GLN . . . . . 0.466 ' O ' HG23 ' B' ' 103' ' ' VAL . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' ILE . . . . . 0.42 HD11 HG21 ' B' ' 9' ' ' VAL . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 101' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 99' ' ' GLN . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' VAL . . . . . 0.633 ' HB ' HG12 ' B' ' 81' ' ' VAL . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' ASN . . . . . 0.59 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 117' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' B' ' 120' ' ' LEU . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' CYS . . . . . 0.779 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 120' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' B' ' 117' ' ' LYS . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' ARG . . . . . 0.625 ' HG3' HD12 ' B' ' 84' ' ' ILE . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' ASP . . . . . 0.538 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' GLN . . . . . 0.538 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 145' ' ' SER . . . . . 0.59 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 149' ' ' ARG . . . . . 0.767 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' ASP . . . . . 0.458 ' HA ' HD11 ' B' ' 23' ' ' LEU . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' ILE . . . . . 0.556 HG22 ' HE2' ' B' ' 167' ' ' LYS . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 167' ' ' LYS . . . . . 0.556 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 168' ' ' GLU . . . . . 0.666 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 172' ' ' LYS . . . . . 0.666 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 55.3 mtmt . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 358' ' ' ILE . . . . . 0.516 ' O ' HG13 ' D' ' 369' ' ' VAL . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 359' ' ' ARG . . . . . 0.659 ' HA ' HG22 ' D' ' 369' ' ' VAL . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 361' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' D' ' 425' ' ' GLU . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 369' ' ' VAL . . . . . 0.802 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 371' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' B' ' 36' ' ' ILE . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 373' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' D' ' 373' ' ' ARG . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 378' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 426' ' ' LEU . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 384' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' D' ' 387' ' ' LYS . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 387' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' D' ' 384' ' ' LYS . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 388' ' ' VAL . . . . . 0.656 ' HB ' HG21 ' B' ' 21' ' ' ILE . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 389' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' D' ' 389' ' ' ARG . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 395' ' ' CYS . . . . . 0.464 ' O ' ' HA ' ' D' ' 430' ' ' PHE . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 399' ' ' PHE . . . . . 0.709 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 400' ' ' ARG . . . . . 0.465 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 410' ' ' ALA . . . . . 0.465 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 411' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' D' ' 411' ' ' ARG . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 416' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 425' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' D' ' 361' ' ' PHE . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 426' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 378' ' ' LEU . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 429' ' ' ASP . . . . . 0.709 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 430' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 437' ' ' THR . . . . . 0.525 ' HB ' HG21 ' D' ' 467' ' ' THR . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 440' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' D' ' 465' ' ' CYS . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 443' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' D' ' 443' ' ' ARG . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 446' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' D' ' 471' ' ' LYS . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 450' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 460' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' D' ' 461' ' ' ASN . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 461' ' ' ASN . . . . . 0.401 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 465' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 467' ' ' THR . . . . . 0.525 HG21 ' HB ' ' D' ' 437' ' ' THR . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 471' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' D' ' 450' ' ' ALA . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' D' D ' 472' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 473' ' ' HIS . . . . . 0.5 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 476' ' ' CYS . . . . . 0.692 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 480' ' ' VAL . . . . . 0.418 HG12 ' O ' ' D' ' 476' ' ' CYS . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 221' ' ' LEU . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' GLN . . . . . 0.467 ' O ' HG23 ' A' ' 224' ' ' VAL . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 218' ' ' ARG . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.67 HG22 ' HD3' ' C' ' 550' ' ' LYS . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.621 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.621 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.439 HD13 H441 ' A' ' 404' ' ' PCW . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.41 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.652 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 250' ' ' VAL . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.805 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 254' ' ' VAL . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.805 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.464 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.467 ' HG ' HG22 ' A' ' 254' ' ' VAL . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.665 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 273' ' ' ARG . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.718 ' HG2' HD21 ' C' ' 499' ' ' LEU . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.458 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.575 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 290' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.464 ' HB3' HD12 ' A' ' 301' ' ' LEU . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.527 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' C' ' 473' ' ' LYS . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 304' ' ' GLU . . . . . 0.406 ' OE2' HD22 ' C' ' 469' ' ' LEU . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.431 ' HG3' HD11 ' C' ' 469' ' ' LEU . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.664 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 315' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 319' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.469 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.762 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.4 ' HD3' HH11 ' A' ' 330' ' ' ARG . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 338' ' ' LEU . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 363' ' ' LYS . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 361' ' ' SER . . . . . 0.57 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 364' ' ' ALA . . . . . 0.721 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.982 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.982 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.67 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 364' ' ' ALA . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 376' ' ' LEU . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 384' ' ' VAL . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 380' ' ' GLU . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.92 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' SER . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.806 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 400' ' ' LYS . . . . . 0.42 ' HB3' ' HB2' ' C' ' 403' ' ' ASP . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 403' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' C' ' 400' ' ' LYS . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.416 ' O ' HG23 ' C' ' 408' ' ' VAL . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.416 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.645 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.459 ' HD1' HD12 ' C' ' 415' ' ' LEU . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' C' ' 411' ' ' THR . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.549 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.473 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.486 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' C' ' 435' ' ' GLU . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 437' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' C' ' 440' ' ' GLU . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.476 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' C' ' 437' ' ' LEU . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 441' ' ' MET . . . . . 0.476 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.732 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.563 ' O ' HG12 ' C' ' 448' ' ' VAL . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.732 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.615 HG23 HG22 ' C' ' 448' ' ' VAL . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' C' ' 456' ' ' LEU . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.48 ' CE1' H281 ' C' ' 602' ' ' PCW . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.481 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.634 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.644 ' HA ' ' CG ' ' C' ' 475' ' ' GLU . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.534 ' HG2' HD13 ' A' ' 301' ' ' LEU . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.644 ' CG ' ' HA ' ' C' ' 471' ' ' ARG . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' C' ' 477' ' ' LEU . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' C' ' 475' ' ' GLU . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB3' ' NH1' ' C' ' 486' ' ' ARG . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 486' ' ' ARG . . . . . 0.417 ' NH1' ' HB3' ' C' ' 482' ' ' GLN . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 492' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' C' ' 496' ' ' LEU . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.437 ' HE3' HD22 ' A' ' 279' ' ' LEU . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' C' ' 492' ' ' LEU . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.78 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.78 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 275' ' ' LYS . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.505 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' C' ' 508' ' ' ARG . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' C' ' 505' ' ' ASP . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.665 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.558 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.524 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 513' ' ' ALA . . . . . 0.431 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.677 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.652 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.458 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 535' ' ' ALA . . . . . 0.515 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.67 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 570' ' ' ARG . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HA ' HG12 ' C' ' 576' ' ' VAL . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.493 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' C' ' 577' ' ' LEU . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.511 ' O ' HG23 ' C' ' 582' ' ' VAL . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 578' ' ' GLU . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.806 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.92 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' HB ' ' B' ' 50' ' ' THR . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' B' ' 52' ' ' LEU . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.649 HD11 HD22 ' B' ' 53' ' ' LEU . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.654 HG12 ' HB2' ' B' ' 79' ' ' LEU . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLY . . . . . 0.479 ' HA2' ' HE1' ' B' ' 32' ' ' TYR . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.412 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.706 ' HA3' ' H8 ' ' B' ' 216' ' ' GNP . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.564 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.497 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.494 HD13 HG12 ' B' ' 152' ' ' VAL . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' B' ' 42' ' ' LYS . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.484 ' CD ' ' H ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.479 ' HE1' ' HA2' ' B' ' 13' ' ' GLY . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.761 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HB2' HD12 ' B' ' 24' ' ' ILE . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.528 ' HB2' HH12 ' B' ' 164' ' ' ARG . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 51' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 3' ' ' GLU . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.649 HD22 HD11 ' B' ' 6' ' ' LEU . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.431 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' TYR . . . . . 0.414 ' HE1' ' NH2' ' B' ' 102' ' ' ARG . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.616 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.646 ' HA3' HD21 ' B' ' 159' ' ' LEU . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.849 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' B' ' 8' ' ' VAL . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.412 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.79 HD11 ' HA ' ' B' ' 118' ' ' CYS . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 93' ' ' ILE . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.45 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' ARG . . . . . 0.414 ' NH2' ' HE1' ' B' ' 64' ' ' TYR . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.45 HG23 ' O ' ' B' ' 99' ' ' GLN . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.849 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.678 HG13 ' HG2' ' B' ' 140' ' ' PRO . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' B' ' 141' ' ' PHE . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.613 HG22 ' HB ' ' B' ' 142' ' ' ILE . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.484 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.79 ' HA ' HD11 ' B' ' 84' ' ' ILE . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.484 HD12 ' HB3' ' B' ' 117' ' ' LYS . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.699 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.533 ' HG3' HD12 ' B' ' 84' ' ' ILE . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.458 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.479 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.678 ' HG2' HG13 ' B' ' 112' ' ' VAL . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' B' ' 113' ' ' LEU . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' B' ' 114' ' ' VAL . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.527 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.4 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' VAL . . . . . 0.494 HG12 HD13 ' B' ' 23' ' ' LEU . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 153' ' ' ASP . . . . . 0.667 ' HB2' ' H63' ' B' ' 210' ' ' PCW . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.472 ' CD2' ' H61' ' D' ' 503' ' ' PCW . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.647 HD23 HD22 ' B' ' 6' ' ' LEU . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.502 ' OE1' ' H61' ' D' ' 507' ' ' PCW . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.528 HH12 ' HB2' ' B' ' 47' ' ' ASP . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.467 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.533 ' OE1' ' H61' ' D' ' 504' ' ' PCW . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.599 ' HD3' ' H1A' ' A' ' 409' ' ' 17F . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.661 ' HD2' ' H6A' ' A' ' 409' ' ' 17F . 52.5 mtmt -93.58 -46.98 7.04 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -81.85 -48.2 11.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.811 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 74.73 32.53 57.11 Favored Glycine 0 C--O 1.238 0.387 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.398 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 22.1 tptt 58.35 28.74 17.17 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.291 0.567 . . . . 10.0 111.579 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 24.7 tptp -81.38 -50.9 8.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.726 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? 73.28 -69.86 0.18 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.812 0.695 . . . . 10.0 112.178 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -135.83 163.65 29.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 10.0 111.126 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -100.71 -89.39 0.34 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.202 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 180' ' ' LYS . . . . . 0.56 ' HA ' ' HE3' ' B' ' 180' ' ' LYS . 0.5 OUTLIER -135.47 145.45 47.17 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.935 0.397 . . . . 10.0 110.185 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.1 m -118.36 141.87 48.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.14 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttm -146.29 139.96 26.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.68 0.276 . . . . 10.0 110.646 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 12.5 t -98.49 174.28 6.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.62 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -69.7 138.74 53.16 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.037 -0.357 . . . . 10.0 110.037 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 65.7 m . . . . . 0 C--O 1.236 0.352 0 O-C-N 123.397 0.436 . . . . 10.0 111.673 -179.888 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 360' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' D' ' 368' ' ' THR . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 361' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' D' ' 427' ' ' GLN . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.623 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.623 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 364' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' D' ' 436' ' ' LEU . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.535 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.761 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 372' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' D' ' 381' ' ' CYS . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 373' ' ' ARG . . . . . 0.475 ' HG3' ' H ' ' D' ' 374' ' ' ASN . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 374' ' ' ASN . . . . . 0.475 ' H ' ' HG3' ' D' ' 373' ' ' ARG . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.501 HD22 HD22 ' D' ' 426' ' ' LEU . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 379' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' D' ' 382' ' ' LEU . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 381' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.858 HD21 HG21 ' D' ' 428' ' ' VAL . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 386' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' D' ' 393' ' ' PRO . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 393' ' ' PRO . . . . . 0.468 ' HD3' HD21 ' D' ' 386' ' ' LEU . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 395' ' ' CYS . . . . . 0.685 ' HA ' ' HB3' ' D' ' 432' ' ' ASP . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 396' ' ' CYS . . . . . 0.503 ' HB3' HG12 ' D' ' 428' ' ' VAL . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.434 ' HB3' ' HB3' ' D' ' 409' ' ' LYS . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' D' ' 426' ' ' LEU . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 401' ' ' LEU . . . . . 0.48 HD13 ' HB2' ' D' ' 425' ' ' GLU . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.44 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.434 ' HB3' ' HB3' ' D' ' 399' ' ' PHE . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 410' ' ' ALA . . . . . 0.491 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.463 ' HA ' HD23 ' D' ' 412' ' ' LEU . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.463 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.48 ' HB2' HD13 ' D' ' 401' ' ' LEU . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.523 HD12 ' HA ' ' D' ' 400' ' ' ARG . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 427' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' D' ' 361' ' ' PHE . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.858 HG21 HD21 ' D' ' 382' ' ' LEU . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 432' ' ' ASP . . . . . 0.685 ' HB3' ' HA ' ' D' ' 395' ' ' CYS . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 434' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 435' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 436' ' ' LEU . . . . . 0.527 ' HA ' ' HB2' ' D' ' 364' ' ' ASN . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 447' ' ' LEU . . . . . 0.543 HD23 ' H52' ' D' ' 506' ' ' PCW . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 448' ' ' LYS . . . . . 0.697 ' HD3' ' H51' ' D' ' 503' ' ' PCW . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.44 ' HE1' ' H42' ' D' ' 509' ' ' PCW . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' D' ' 459' ' ' LEU . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 456' ' ' GLN . . . . . 0.489 ' O ' ' HD2' ' D' ' 457' ' ' LYS . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 457' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' D' ' 456' ' ' GLN . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.64 ' HB2' ' HB2' ' D' ' 452' ' ' CYS . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.423 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.423 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' D' ' 470' ' ' TYR . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 470' ' ' TYR . . . . . 0.415 ' HB3' ' SG ' ' D' ' 465' ' ' CYS . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.963 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 474' ' ' GLU . . . . . 0.568 ' CD ' ' H42' ' B' ' 206' ' ' PCW . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.963 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 481' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 483' ' ' MET . . . . . 0.582 ' HG3' ' H ' ' D' ' 484' ' ' CYS . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.582 ' H ' ' HG3' ' D' ' 483' ' ' MET . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.022 H472 H271 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 0.816 H241 H461 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.084 H212 H171 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 0.866 ' O11' H152 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.243 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.986 H371 ' H40' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.047 H371 H272 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.076 H121 ' C1Z' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.076 ' C1Z' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.58 ' O2 ' ' H2 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.062 H452 H421 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 1.133 H431 H472 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.109 H422 H231 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 0.939 H261 H182 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.107 H451 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.071 H122 ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 0.994 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.968 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.057 H341 ' H61' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.042 H421 H362 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.136 H482 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 0.866 H231 ' C38' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.05 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.094 H261 ' H62' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.079 H172 H331 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.951 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.097 ' C32' H352 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.109 H231 H422 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 0.979 H251 ' H47' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 1.003 H262 H442 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.079 H331 H172 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.079 ' H39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 0.973 ' H41' ' O31' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.104 H151 H142 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 0.903 H211 H482 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.988 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.043 H141 ' H6 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.054 H162 H152 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.097 H352 ' C32' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.051 ' H19' H151 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.136 H282 H482 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.104 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.04 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.086 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.981 ' C1Y' H172 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 1.094 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.071 ' C9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.0 ' H31' H212 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 0.971 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 0.922 H181 H211 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.032 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 0.823 ' O4P' ' H31' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.033 H152 H382 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 0.81 ' H42' ' O1 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 0.967 ' H2 ' ' H4A' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.001 H231 H472 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.046 ' H42' ' H2 ' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.986 ' H40' H371 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.047 H272 H371 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.127 H121 H371 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.033 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.001 ' H53' H262 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.057 ' H61' H341 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.043 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.706 ' H8 ' ' HA3' ' B' ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 0.997 H261 ' H64' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.082 H412 H352 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.022 H283 H451 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 0.992 H342 ' H6 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.101 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.051 H282 H421 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.135 H431 ' H30' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.274 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.059 H412 H371 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.021 ' H2 ' ' H42' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.067 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.023 ' C12' ' H41' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.135 ' H30' H431 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 0.878 ' H58' ' H2 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.107 H211 H451 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.054 H152 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.537 HD21 HD21 ' C' ' 569' ' ' LEU . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' THR . . . . . 0.528 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 214' ' ' PHE . . . . . 0.447 ' HZ ' H162 ' A' ' 402' ' ' PCW . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 213' ' ' THR . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.585 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.585 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.641 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.551 ' O ' ' HG3' ' A' ' 240' ' ' ARG . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.518 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 236' ' ' THR . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.631 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 250' ' ' VAL . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.71 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.447 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.534 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 9.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.489 ' HG ' HG22 ' A' ' 254' ' ' VAL . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.458 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.563 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 268' ' ' GLU . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 265' ' ' TRP . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.419 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.41 ' O ' HG12 ' A' ' 276' ' ' VAL . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.741 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.589 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 289' ' ' GLN . . . . . 0.406 ' HG2' ' OE2' ' A' ' 293' ' ' GLU . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 292' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 289' ' ' GLN . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.596 ' HG3' HD21 ' C' ' 477' ' ' LEU . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.509 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.567 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.567 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.599 ' HB3' ' HE3' ' C' ' 473' ' ' LYS . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.509 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.51 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.682 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.592 ' HG3' HD21 ' C' ' 469' ' ' LEU . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.682 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' A' ' 320' ' ' LEU . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.522 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.69 HD23 ' HD2' ' A' ' 330' ' ' ARG . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.751 HH21 ' HB3' ' C' ' 447' ' ' GLU . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.437 ' HG2' ' OE1' ' C' ' 440' ' ' GLU . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.511 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.761 HD21 ' HB3' ' C' ' 432' ' ' LYS . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.511 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 346' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.5 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 356' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.783 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.792 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.792 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.783 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.663 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 393' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 397' ' ' LEU . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.718 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 397' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 393' ' ' TYR . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 401' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.438 ' O ' HG23 ' C' ' 408' ' ' VAL . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 405' ' ' TRP . . . . . 0.461 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.438 HG23 ' O ' ' C' ' 404' ' ' ASN . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.415 HG23 ' HE2' ' A' ' 363' ' ' LYS . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.42 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' C' ' 413' ' ' SER . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 418' ' ' GLN . . . . . 0.578 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.509 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.761 ' HB3' HD21 ' A' ' 341' ' ' ASN . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 345' ' ' ARG . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.437 ' OE1' ' HG2' ' A' ' 334' ' ' ARG . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.733 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.441 ' O ' HG12 ' C' ' 448' ' ' VAL . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.751 ' HB3' HH21 ' A' ' 330' ' ' ARG . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.733 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' C' ' 456' ' ' LEU . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.51 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' C' ' 452' ' ' VAL . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.535 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.57 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 468' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' C' ' 471' ' ' ARG . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.592 HD21 ' HG3' ' A' ' 308' ' ' ARG . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' C' ' 468' ' ' GLU . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.599 ' HE3' ' HB3' ' A' ' 301' ' ' LEU . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 474' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.596 HD21 ' HG3' ' A' ' 297' ' ' LYS . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.741 ' HE3' HD22 ' A' ' 279' ' ' LEU . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.558 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.885 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.437 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 504' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.654 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.563 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.444 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 513' ' ' ALA . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.586 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.67 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.646 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.458 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.631 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.565 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.721 HD23 HD12 ' C' ' 536' ' ' LEU . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.721 HD12 HD23 ' C' ' 533' ' ' LEU . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 543' ' ' ARG . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 548' ' ' HIS . . . . . 0.596 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' C' ' 558' ' ' LEU . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.86 ' HA ' ' HE3' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 565' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.537 HD21 HD21 ' A' ' 206' ' ' ASN . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.573 ' HA ' HG12 ' C' ' 576' ' ' VAL . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.573 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.538 ' O ' HG23 ' C' ' 582' ' ' VAL . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.538 HG23 ' O ' ' C' ' 578' ' ' GLU . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 584' ' ' PHE . . . . . 0.525 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.718 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 588' ' ' LEU . . . . . 0.801 HD22 ' H48' ' C' ' 630' ' ' 17F . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.663 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.583 ' HB2' ' HG3' ' B' ' 76' ' ' GLU . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.644 HD22 HD23 ' B' ' 159' ' ' LEU . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' B' ' 80' ' ' CYS . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.425 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.656 HD13 HG11 ' D' ' 388' ' ' VAL . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.469 HD22 HG12 ' B' ' 152' ' ' VAL . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.582 HD13 ' HD3' ' B' ' 42' ' ' LYS . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.484 ' HE1' HNB3 ' B' ' 216' ' ' GNP . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.661 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.706 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.448 ' HB3' HG13 ' B' ' 24' ' ' ILE . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.582 ' HD3' HD13 ' B' ' 24' ' ' ILE . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' D' ' 467' ' ' THR . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 44' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' B' ' 46' ' ' ILE . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' D' ' 464' ' ' ARG . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.502 HG13 ' HB ' ' B' ' 44' ' ' VAL . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.426 ' H ' HD12 ' D' ' 447' ' ' LEU . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.547 ' HA ' ' HE3' ' D' ' 471' ' ' LYS . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.475 HD22 HD11 ' B' ' 6' ' ' LEU . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.661 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.434 ' HE3' HG21 ' B' ' 103' ' ' VAL . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLU . . . . . 0.583 ' HG3' ' HB2' ' B' ' 5' ' ' LYS . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.52 ' O ' ' HA ' ' B' ' 111' ' ' MET . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.947 ' HG ' HD22 ' B' ' 159' ' ' LEU . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.523 ' HB2' HD12 ' B' ' 93' ' ' ILE . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.696 HG12 ' HB ' ' B' ' 114' ' ' VAL . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.558 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.925 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.558 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' ASN . . . . . 0.48 ' ND2' ' HB3' ' B' ' 88' ' ' LYS . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LYS . . . . . 0.48 ' HB3' ' ND2' ' B' ' 86' ' ' ASN . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.504 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' B' ' 82' ' ' PHE . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 97' ' ' ARG . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.435 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 99' ' ' GLN . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' SER . . . . . 0.473 ' HB2' HG13 ' B' ' 109' ' ' VAL . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' VAL . . . . . 0.473 HG13 ' HB2' ' B' ' 106' ' ' SER . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' B' ' 109' ' ' VAL . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.618 ' HB ' HD23 ' B' ' 79' ' ' LEU . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.696 ' HB ' HG12 ' B' ' 81' ' ' VAL . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' B' ' 144' ' ' THR . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.925 ' HA ' HD11 ' B' ' 84' ' ' ILE . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.871 ' HG3' HD12 ' B' ' 84' ' ' ILE . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.613 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.529 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.613 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' B' ' 127' ' ' THR . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.652 ' HA ' ' H63' ' B' ' 209' ' ' PCW . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ALA . . . . . 0.444 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.817 ' NH2' ' H2 ' ' B' ' 209' ' ' PCW . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.444 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.459 ' HG2' HG13 ' B' ' 112' ' ' VAL . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.417 ' HB3' ' N7 ' ' B' ' 216' ' ' GNP . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 23' ' ' LEU . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ASP . . . . . 0.466 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.466 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.568 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.947 HD22 ' HG ' ' B' ' 79' ' ' LEU . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -110.95 11.44 22.22 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -101.04 -69.31 0.78 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.447 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 68.39 23.57 75.04 Favored Glycine 0 C--N 1.331 0.262 0 CA-C-N 116.034 -0.53 . . . . 10.0 113.56 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 67.37 56.32 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.371 0.605 . . . . 10.0 110.929 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.7 136.27 38.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.229 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -92.08 128.93 38.1 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 159.62 30.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.03 0.443 . . . . 10.0 111.07 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 179' ' ' LYS . . . . . 0.461 ' HG3' ' H62' ' A' ' 403' ' ' PCW . 3.2 tptm -133.45 99.18 4.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.73 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -147.25 126.71 13.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.594 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 181' ' ' SER . . . . . 0.714 ' HA ' H372 ' B' ' 209' ' ' PCW . 24.3 m -151.22 136.14 17.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.616 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.435 ' HE3' ' C43' ' B' ' 209' ' ' PCW . 18.6 ptpt -136.51 130.47 32.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.824 -0.436 . . . . 10.0 109.824 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 183' ' ' THR . . . . . 0.473 HG23 ' H ' ' B' ' 184' ' ' LYS . 0.0 OUTLIER -106.54 -66.95 0.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.704 -0.225 . . . . 10.0 111.008 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.473 ' H ' HG23 ' B' ' 183' ' ' THR . 68.0 mmtt 57.63 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 122.91 0.484 . . . . 10.0 112.119 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 63.0 m . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.605 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.536 ' HG3' HG22 ' D' ' 369' ' ' VAL . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.748 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.748 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 364' ' ' ASN . . . . . 0.458 ' HB3' ' H ' ' D' ' 365' ' ' LYS . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 365' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' D' ' 364' ' ' ASN . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.706 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.428 HD12 ' O ' ' D' ' 413' ' ' ASP . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.656 HD21 HG21 ' D' ' 428' ' ' VAL . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 387' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.656 HG11 HD13 ' B' ' 21' ' ' ILE . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 389' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' D' ' 389' ' ' ARG . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 397' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.639 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.639 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' D' ' 413' ' ' ASP . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 413' ' ' ASP . . . . . 0.47 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' D' ' 359' ' ' ARG . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.656 HG21 HD21 ' D' ' 382' ' ' LEU . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 430' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' D' ' 433' ' ' HIS . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.533 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 433' ' ' HIS . . . . . 0.412 ' HB3' ' HB3' ' D' ' 430' ' ' PHE . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 435' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' D' ' 436' ' ' LEU . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 436' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 444' ' ' LYS . . . . . 0.698 ' HB2' ' HD3' ' D' ' 464' ' ' ARG . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 446' ' ' PHE . . . . . 0.538 ' O ' ' H63' ' D' ' 501' ' ' PCW . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 447' ' ' LEU . . . . . 0.426 HD12 ' H ' ' B' ' 47' ' ' ASP . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 448' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 47' ' ' ASP . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 450' ' ' ALA . . . . . 0.497 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 458' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.785 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.45 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.698 ' HD3' ' HB2' ' D' ' 444' ' ' LYS . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.662 ' HB2' ' H ' ' D' ' 470' ' ' TYR . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 467' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' B' ' 43' ' ' GLN . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 469' ' ' GLY . . . . . 0.562 ' N ' ' HB2' ' D' ' 465' ' ' CYS . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 470' ' ' TYR . . . . . 0.662 ' H ' ' HB2' ' D' ' 465' ' ' CYS . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.785 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.814 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 473' ' ' HIS . . . . . 0.54 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.16 H252 H281 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 1.004 H272 H241 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.058 ' C16' H212 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.046 H242 H231 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.209 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.951 H431 ' H19' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.006 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.003 H121 ' H71' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.003 ' H71' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.823 ' C33' H241 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 0.769 ' H11' ' H32' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 0.953 H431 H481 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.12 H431 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 0.954 ' C40' H441 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.102 H362 H412 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.05 H321 ' H52' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.053 H141 H382 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.996 H472 H432 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.084 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.057 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.029 H332 H122 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.005 H442 H483 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.092 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.03 ' H41' H222 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.103 H271 ' H73' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.841 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.017 H172 H351 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.12 ' C17' H431 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.059 H121 H382 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 1.16 H281 H252 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 0.851 ' C22' H272 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.022 H482 H222 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.102 H412 H362 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.062 H422 H282 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.059 H382 H121 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.952 H372 H412 ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.011 H181 H142 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.038 H162 H172 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.128 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 0.983 H412 H412 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.03 H222 ' H41' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.062 H282 H422 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.103 ' H73' H271 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.12 ' H69' ' C8 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.998 ' H33' H141 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 0.869 ' H70' ' H36' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.078 ' H58' ' H65' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 0.877 ' H5 ' ' C19' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.035 ' H75' ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.025 H132 H271 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.052 H161 H322 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.104 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.067 ' H32' H152 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.014 H142 H321 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.087 ' H31' ' H41' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.014 H321 H142 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.067 H152 ' H32' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.817 ' H2 ' ' NH2' ' B' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.121 H262 H252 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.09 H352 ' O31' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 0.99 H242 H432 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 0.907 ' H1 ' ' H12' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 0.994 ' H8A' ' H11' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.12 ' C8 ' ' H69' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.739 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . 0.739 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.057 H483 H232 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.042 H432 ' H20' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.121 H252 H262 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.052 H322 H161 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.042 H222 H181 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.025 H161 H461 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.088 H371 H412 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.137 H382 H232 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.066 ' H51' ' H12' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.113 H181 ' H48' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.051 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.077 ' H65' H371 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.113 ' H48' H181 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 0.853 ' H61' ' H30' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.057 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.038 H172 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.417 ' HA ' HD12 ' A' ' 204' ' ' LEU . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 201' ' ' LEU . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' THR . . . . . 0.468 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 222' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 226' ' ' GLN . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 226' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 222' ' ' GLY . 66.2 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.642 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.869 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.869 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 235' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 239' ' ' LEU . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.559 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 235' ' ' GLU . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.559 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.749 ' HG3' HD12 ' A' ' 247' ' ' LEU . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.593 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.569 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.749 HD12 ' HG3' ' A' ' 243' ' ' MET . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.593 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.575 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.575 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.533 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.533 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.408 ' HG ' HG22 ' A' ' 254' ' ' VAL . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.603 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.464 ' O ' ' HB2' ' A' ' 269' ' ' MET . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 269' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 265' ' ' TRP . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 274' ' ' GLN . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 274' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 270' ' ' GLU . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.707 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.435 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.471 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 286' ' ' GLY . . . . . 0.403 ' O ' ' HG3' ' A' ' 290' ' ' LYS . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 290' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 286' ' ' GLY . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.484 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.42 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.771 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.771 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' C' ' 473' ' ' LYS . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.592 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.619 ' HG3' HD11 ' C' ' 469' ' ' LEU . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.592 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.582 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.67 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.67 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.595 HH21 ' HB3' ' C' ' 447' ' ' GLU . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.55 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.55 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.502 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 364' ' ' ALA . . . . . 0.461 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.884 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.884 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 364' ' ' ALA . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 368' ' ' LEU . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 375' ' ' LEU . . . . . 0.418 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 375' ' ' LEU . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 384' ' ' VAL . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 380' ' ' GLU . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.461 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.615 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.491 ' O ' HG23 ' C' ' 408' ' ' VAL . 58.8 t30 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.491 HG23 ' O ' ' C' ' 404' ' ' ASN . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.568 ' HD1' HD12 ' C' ' 415' ' ' LEU . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.568 HD12 ' HD1' ' C' ' 412' ' ' PHE . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.419 ' HA ' HD12 ' C' ' 430' ' ' LEU . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.502 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' C' ' 427' ' ' TRP . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 436' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' C' ' 440' ' ' GLU . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 437' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 436' ' ' GLY . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.578 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.595 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.492 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.619 HD11 ' HG3' ' A' ' 308' ' ' ARG . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.666 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.62 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 483' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' C' ' 487' ' ' GLN . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' C' ' 483' ' ' GLU . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 493' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.668 ' HE3' HD22 ' A' ' 279' ' ' LEU . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.519 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.883 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.883 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.621 HD21 ' HG2' ' A' ' 275' ' ' LYS . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.519 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.534 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.58 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.58 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.603 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.569 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' C' ' 515' ' ' ARG . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' C' ' 519' ' ' ALA . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 1.8 m-70 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.69 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' C' ' 526' ' ' ARG . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' C' ' 522' ' ' SER . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.569 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.601 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.677 ' HB3' ' HE3' ' C' ' 563' ' ' LYS . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.677 ' HE3' ' HB3' ' C' ' 559' ' ' SER . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 571' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.531 ' HA ' HG12 ' C' ' 576' ' ' VAL . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' C' ' 581' ' ' LYS . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' C' ' 578' ' ' GLU . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.615 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.423 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 595' ' ' LEU . . . . . 0.444 HD12 ' H47' ' C' ' 630' ' ' 17F . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.588 ' HA2' ' H8 ' ' B' ' 216' ' ' GNP . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.459 ' HZ1' ' PG ' ' B' ' 216' ' ' GNP . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.591 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.885 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 152' ' ' VAL . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.832 HG23 ' HD3' ' B' ' 42' ' ' LYS . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PHE . . . . . 0.486 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.804 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.871 ' HB3' HG23 ' D' ' 369' ' ' VAL . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.799 ' HE1' ' HB2' ' B' ' 57' ' ' ASP . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.832 ' HD3' HG23 ' B' ' 24' ' ' ILE . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' VAL . . . . . 0.489 HG12 ' NH2' ' D' ' 464' ' ' ARG . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' HD12 ' D' ' 447' ' ' LEU . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.695 ' HA ' ' HD3' ' D' ' 448' ' ' LYS . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.729 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' B' ' 40' ' ' TYR . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB2' ' HE1' ' B' ' 40' ' ' TYR . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.804 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.442 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 73' ' ' ARG . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.813 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' B' ' 112' ' ' VAL . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 113' ' ' LEU . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' B' ' 114' ' ' VAL . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.404 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.765 HD11 ' HA ' ' B' ' 118' ' ' CYS . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' B' ' 82' ' ' PHE . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.453 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.518 ' O ' HG23 ' B' ' 103' ' ' VAL . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 99' ' ' GLN . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.813 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.693 ' HB ' HD23 ' B' ' 79' ' ' LEU . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' B' ' 80' ' ' CYS . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.54 ' HB ' HG12 ' B' ' 81' ' ' VAL . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.765 ' HA ' HD11 ' B' ' 84' ' ' ILE . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.485 ' NH2' ' HB2' ' B' ' 118' ' ' CYS . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.512 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' B' ' 133' ' ' LEU . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.672 ' CZ ' ' H82' ' B' ' 209' ' ' PCW . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ILE . . . . . 0.741 HG21 ' HB2' ' B' ' 155' ' ' ALA . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' GLU . . . . . 1.035 ' HB3' ' H62' ' B' ' 204' ' ' PCW . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.643 ' HB ' HG22 ' B' ' 152' ' ' VAL . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.885 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' VAL . . . . . 0.643 HG22 ' HB ' ' B' ' 144' ' ' THR . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ASP . . . . . 0.535 ' OD1' ' H52' ' B' ' 212' ' ' PCW . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 155' ' ' ALA . . . . . 0.741 ' HB2' HG21 ' B' ' 142' ' ' ILE . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.591 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.678 HD22 ' HG ' ' B' ' 79' ' ' LEU . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.591 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 162' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.432 HG13 ' O ' ' B' ' 159' ' ' LEU . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' B' ' 164' ' ' ARG . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.477 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -80.09 -7.2 58.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -103.66 -46.79 4.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.352 . . . . 10.0 110.424 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.68 -75.29 2.15 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.909 -0.662 . . . . 10.0 112.175 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.544 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 0.2 OUTLIER -169.46 52.43 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.1 0.476 . . . . 10.0 110.27 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -98.05 97.98 9.37 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.621 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -107.43 83.45 1.81 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.923 0.392 . . . . 10.0 111.348 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -165.56 113.02 0.95 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.027 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -121.23 125.35 46.9 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.243 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -116.05 103.29 10.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.642 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 14.2 t -100.38 135.02 42.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 10.0 110.736 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -86.82 -39.56 15.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.317 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.45 131.81 26.76 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.13 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -87.85 -39.88 14.46 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.237 0.418 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.87 179.535 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.439 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 361' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' D' ' 426' ' ' LEU . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.511 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.511 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 367' ' ' ARG . . . . . 0.543 ' HD2' ' OE1' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.871 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.447 ' HB2' HD11 ' B' ' 36' ' ' ILE . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 373' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 377' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' D' ' 417' ' ' ASP . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' D' ' 416' ' ' THR . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.819 HD21 HG21 ' D' ' 428' ' ' VAL . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.591 ' CG1' HD13 ' B' ' 21' ' ' ILE . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.434 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 401' ' ' LEU . . . . . 0.58 HD13 ' HB2' ' D' ' 425' ' ' GLU . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 403' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' D' ' 403' ' ' GLN . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 410' ' ' ALA . . . . . 0.434 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.435 HD13 HG21 ' D' ' 416' ' ' THR . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 413' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.494 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 417' ' ' ASP . . . . . 0.663 ' HA ' ' HA ' ' D' ' 377' ' ' SER . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.58 ' HB2' HD13 ' D' ' 401' ' ' LEU . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.819 HG21 HD21 ' D' ' 382' ' ' LEU . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.466 ' HB2' ' H ' ' D' ' 432' ' ' ASP . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 432' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 437' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 467' ' ' THR . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 439' ' ' HIS . . . . . 0.463 ' HA ' ' SG ' ' D' ' 468' ' ' CYS . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 442' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 443' ' ' ARG . . . . . 0.435 ' HB3' ' CE1' ' D' ' 463' ' ' PHE . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 445' ' ' THR . . . . . 0.964 HG21 ' H52' ' D' ' 501' ' ' PCW . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 447' ' ' LEU . . . . . 0.488 HD12 ' O ' ' B' ' 45' ' ' VAL . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 448' ' ' LYS . . . . . 0.695 ' HD3' ' HA ' ' B' ' 47' ' ' ASP . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 449' ' ' LEU . . . . . 0.599 ' H ' ' HG2' ' D' ' 448' ' ' LYS . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 450' ' ' ALA . . . . . 0.729 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.657 ' HA ' HD23 ' D' ' 459' ' ' LEU . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 457' ' ' LYS . . . . . 0.556 ' HG2' ' H ' ' D' ' 458' ' ' PHE . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 458' ' ' PHE . . . . . 0.556 ' H ' ' HG2' ' D' ' 457' ' ' LYS . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.657 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.48 ' HG ' ' H ' ' D' ' 460' ' ' LEU . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 463' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' D' ' 443' ' ' ARG . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.489 ' NH2' HG12 ' B' ' 44' ' ' VAL . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 467' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 437' ' ' THR . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.651 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.993 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.993 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.572 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 0.713 H442 H261 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 0.839 H272 H241 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.041 ' C16' H212 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 0.923 ' C35' H162 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.149 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.829 H451 H182 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.037 H431 H232 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.023 H221 H181 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.016 ' H63' H141 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.956 ' H72' H252 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 0.902 H472 H251 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 0.995 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.108 H361 H152 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 0.979 H272 H482 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.046 H432 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.091 H442 ' H20' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.09 H451 ' H75' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.942 H461 ' C42' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 0.986 H131 ' H60' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.088 ' H2 ' ' H41' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 0.966 H381 ' H36' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.13 H182 H362 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.006 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.078 H141 H171 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.078 H171 H141 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.878 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.068 H172 H351 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.108 H152 H361 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.13 H362 H182 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 1.014 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.034 ' H51' ' O5 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.055 ' C39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.091 ' H20' H442 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.063 H461 H251 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 0.928 H452 H261 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 1.017 H283 ' H35' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.071 H412 ' H77' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.071 H242 H242 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.152 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.062 H261 H421 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.055 H242 ' H63' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 0.928 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.042 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.071 ' C7 ' H18A ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 1.12 ' H67' ' H36' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 1.001 ' H78' ' H40' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.004 ' H9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.011 ' H31' H212 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.071 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 0.94 H181 H251 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.06 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 0.986 H252 H122 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.081 ' H11' ' H8A' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.047 H181 H342 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.055 H461 ' H68' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.047 H342 H181 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.036 ' C22' H161 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.945 H351 ' H51' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.124 H282 H212 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.063 H251 H461 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 0.998 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.055 ' H68' H461 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.081 ' H8A' ' H11' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.12 ' H36' ' H67' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.742 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . 0.742 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 0.964 ' H52' HG21 ' D' ' 445' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 0.803 H382 H151 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.124 H212 H282 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.016 H121 H171 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.066 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.079 ' H40' H251 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.046 H471 ' H32' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.091 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.065 ' H51' ' H12' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 0.974 H432 H472 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.09 ' H75' H451 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.04 ' H30' ' H35' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.046 ' H32' H471 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.04 ' H35' ' H30' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.046 H211 H432 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.079 H251 ' H40' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 204' ' ' LEU . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.414 HD12 HD23 ' A' ' 201' ' ' LEU . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.498 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.769 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.769 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.49 ' HB ' ' CZ ' ' A' ' 240' ' ' ARG . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 236' ' ' THR . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.643 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.653 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' HG12 ' A' ' 250' ' ' VAL . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.539 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.458 ' O ' HG12 ' A' ' 254' ' ' VAL . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.585 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.585 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.411 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.57 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.52 ' NZ ' ' HB2' ' C' ' 513' ' ' ALA . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.484 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.413 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.763 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 272' ' ' TYR . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.452 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 295' ' ' GLN . . . . . 0.542 ' HA ' ' HB2' ' A' ' 298' ' ' LEU . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 295' ' ' GLN . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.797 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.797 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.609 ' HG3' HD21 ' C' ' 469' ' ' LEU . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.561 ' HA ' HD12 ' A' ' 316' ' ' LEU . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 313' ' ' VAL . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.513 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.453 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.477 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.513 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.535 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.653 HD23 ' HD2' ' A' ' 330' ' ' ARG . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 324' ' ' SER . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.653 ' HD2' HD23 ' A' ' 327' ' ' LEU . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.661 ' HD3' ' OE1' ' C' ' 440' ' ' GLU . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.436 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.446 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 26.6 m80 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 361' ' ' SER . . . . . 0.417 ' HB3' ' HE2' ' A' ' 365' ' ' LYS . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.713 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.846 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.846 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.713 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.401 ' O ' HG23 ' A' ' 384' ' ' VAL . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 380' ' ' GLU . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.573 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.504 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 395' ' ' LYS . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.751 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.577 ' O ' HG23 ' C' ' 408' ' ' VAL . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.577 HG23 ' O ' ' C' ' 404' ' ' ASN . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.442 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' C' ' 413' ' ' SER . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.661 ' OE1' ' HD3' ' A' ' 334' ' ' ARG . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 457' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.468 ' HD2' ' CZ2' ' C' ' 463' ' ' TRP . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.468 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.585 ' CD1' ' H75' ' C' ' 629' ' ' 17F . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.62 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.435 ' OE2' H262 ' C' ' 602' ' ' PCW . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.609 HD21 ' HG3' ' A' ' 308' ' ' ARG . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.484 ' HE2' HD22 ' C' ' 469' ' ' LEU . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 485' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.438 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.582 ' HE3' HD22 ' A' ' 279' ' ' LEU . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.504 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.565 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 279' ' ' LEU . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.623 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.623 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.529 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.668 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 513' ' ' ALA . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.614 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.614 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.664 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.576 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.653 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 529' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.437 HD23 HD12 ' C' ' 536' ' ' LEU . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.403 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.437 HD12 HD23 ' C' ' 533' ' ' LEU . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.424 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.545 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 568' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.458 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.751 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 592' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 596' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' C' ' 592' ' ' THR . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' B' ' 50' ' ' THR . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.432 ' HG3' HD23 ' B' ' 52' ' ' LEU . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.748 HG12 ' HB2' ' B' ' 79' ' ' LEU . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.493 HG21 HD11 ' B' ' 100' ' ' ILE . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.598 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.413 ' NZ ' ' O1G' ' B' ' 216' ' ' GNP . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.488 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.536 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.464 HG23 ' HD3' ' B' ' 42' ' ' LYS . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.449 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.445 ' CD1' H5'1 ' B' ' 216' ' ' GNP . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.679 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.749 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HD3' HG23 ' B' ' 24' ' ' ILE . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.621 ' O ' ' HA3' ' D' ' 469' ' ' GLY . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.539 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' B' ' 1' ' ' MET . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' B' ' 3' ' ' GLU . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.679 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.458 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' TYR . . . . . 0.425 ' HE1' ' HB2' ' B' ' 69' ' ' ASP . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.535 ' HA ' ' CE1' ' B' ' 71' ' ' TYR . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.425 ' HB2' ' HE1' ' B' ' 64' ' ' TYR . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' B' ' 73' ' ' ARG . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.487 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.748 ' HB2' HG12 ' B' ' 8' ' ' VAL . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.626 HG12 ' HB ' ' B' ' 114' ' ' VAL . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.505 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.544 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' ASN . . . . . 0.474 HD21 ' HB3' ' B' ' 88' ' ' LYS . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' B' ' 86' ' ' ASN . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.587 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 89' ' ' SER . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' B' ' 93' ' ' ILE . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 103' ' ' VAL . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.493 HD11 HG21 ' B' ' 9' ' ' VAL . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 99' ' ' GLN . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.453 ' HD3' ' HZ ' ' B' ' 78' ' ' PHE . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.487 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.478 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 93' ' ' ILE . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.626 ' HB ' HG12 ' B' ' 81' ' ' VAL . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.691 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.405 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.458 HD21 HN21 ' B' ' 216' ' ' GNP . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.505 ' HG3' HD13 ' B' ' 84' ' ' ILE . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.799 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.457 ' OG1' ' H73' ' C' ' 601' ' ' PCW . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.799 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.56 ' OE1' ' H51' ' C' ' 602' ' ' PCW . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.512 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.471 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 145' ' ' SER . . . . . 0.691 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.4 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.536 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' VAL . . . . . 0.407 HG22 ' CG2' ' B' ' 144' ' ' THR . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' PHE . . . . . 0.435 ' O ' HG23 ' B' ' 160' ' ' VAL . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.567 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.562 HD22 ' HG ' ' B' ' 79' ' ' LEU . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 156' ' ' PHE . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.538 HG22 ' HE2' ' B' ' 167' ' ' LYS . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' B' ' 164' ' ' ARG . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.58 ' HD3' ' O2P' ' B' ' 206' ' ' PCW . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.538 ' HE2' HG22 ' B' ' 163' ' ' ILE . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.504 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.504 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 56.5 mtmt -71.63 -35.65 70.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -81.23 -52.72 7.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.065 0.459 . . . . 10.0 110.998 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 78.52 -108.09 2.59 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 110.827 -0.909 . . . . 10.0 110.827 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.474 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 26.9 mmtm -136.06 22.96 3.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.184 0.516 . . . . 10.0 109.626 178.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.533 ' HB3' ' H ' ' B' ' 177' ' ' LYS . 13.7 tptt -108.18 -120.7 0.25 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.476 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 177' ' ' LYS . . . . . 0.533 ' H ' ' HB3' ' B' ' 176' ' ' LYS . 2.8 ptmm? -159.54 89.93 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.07 0.462 . . . . 10.0 111.547 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -112.73 -3.59 14.21 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.003 -0.74 . . . . 10.0 109.003 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 179' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' B' ' 179' ' ' LYS . 17.5 pttt -92.96 101.11 13.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.9 -1.046 . . . . 10.0 110.606 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -151.3 33.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.226 0.536 . . . . 10.0 110.885 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 181' ' ' SER . . . . . 0.488 ' HB3' ' O1P' ' B' ' 207' ' ' PCW . 3.6 m -84.01 56.73 3.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.639 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' B' ' 135' ' ' ARG . 55.6 tttm -154.21 93.97 1.67 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.579 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 9.8 t -141.14 -40.27 0.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.541 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -169.68 81.16 0.12 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.145 0.498 . . . . 10.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.465 179.387 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 358' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' D' ' 369' ' ' VAL . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.715 ' HG2' HG22 ' D' ' 369' ' ' VAL . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.966 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.825 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 365' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 365' ' ' LYS . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.966 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.749 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.518 ' HB2' HD11 ' B' ' 36' ' ' ILE . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 426' ' ' LEU . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.501 HD21 HG21 ' D' ' 428' ' ' VAL . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 386' ' ' LEU . . . . . 0.477 HD21 ' HD3' ' D' ' 393' ' ' PRO . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.488 ' CG1' HD13 ' B' ' 21' ' ' ILE . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 393' ' ' PRO . . . . . 0.477 ' HD3' HD21 ' D' ' 386' ' ' LEU . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 395' ' ' CYS . . . . . 0.521 ' HA ' HD11 ' D' ' 431' ' ' LEU . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.422 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.492 ' HD2' HD21 ' D' ' 412' ' ' LEU . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 402' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' D' ' 409' ' ' LYS . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 406' ' ' LYS . . . . . 0.412 ' HE2' ' HB3' ' D' ' 406' ' ' LYS . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.619 ' HA ' HD21 ' D' ' 402' ' ' LEU . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.492 HD21 ' HD2' ' D' ' 400' ' ' ARG . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 378' ' ' LEU . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.501 HG21 HD21 ' D' ' 382' ' ' LEU . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 429' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 430' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' D' ' 395' ' ' CYS . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 432' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 434' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 435' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 437' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 467' ' ' THR . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 445' ' ' THR . . . . . 0.511 HG21 ' H63' ' D' ' 501' ' ' PCW . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 446' ' ' PHE . . . . . 0.516 ' HD1' ' HA ' ' D' ' 461' ' ' ASN . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 450' ' ' ALA . . . . . 0.539 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 456' ' ' GLN . . . . . 0.462 HE22 ' H61' ' D' ' 507' ' ' PCW . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' D' ' 459' ' ' LEU . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 1.062 HD11 H381 ' D' ' 509' ' ' PCW . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.516 ' HA ' ' HD1' ' D' ' 446' ' ' PHE . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 463' ' ' PHE . . . . . 0.43 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.563 ' HB2' ' H ' ' D' ' 469' ' ' GLY . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 467' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 437' ' ' THR . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' D' D ' 469' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' B' ' 43' ' ' GLN . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 474' ' ' GLU . . . . . 0.43 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.425 HG22 ' H ' ' D' ' 482' ' ' THR . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 482' ' ' THR . . . . . 0.425 ' H ' HG22 ' D' ' 480' ' ' VAL . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 485' ' ' VAL . . . . . 0.683 HG12 ' HZ3' ' D' ' 487' ' ' TRP . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 487' ' ' TRP . . . . . 0.683 ' HZ3' HG12 ' D' ' 485' ' ' VAL . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.087 H452 H271 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 0.874 H382 H461 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 0.956 ' H61' H371 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.105 H351 H152 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.257 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.956 H371 ' H61' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.105 H152 H351 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.06 H371 ' H31' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.044 ' H52' H411 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 1.021 ' H70' H281 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.038 H451 H242 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 1.082 H472 H483 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.039 H332 H132 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 1.04 H431 ' C46' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.05 H432 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.003 H371 H362 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.059 ' H62' ' H2 ' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 1.003 H151 H471 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.094 H483 ' H65' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.094 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.089 H461 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.038 H211 H382 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.04 ' H82' ' H2 ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.125 H181 ' H11' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 0.996 H171 ' C12' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 1.016 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.087 H271 H452 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.069 H212 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.038 H382 H211 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 0.984 H262 H432 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.06 H221 H251 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.103 ' H39' ' C14' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.038 H242 H451 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.103 ' C14' ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.06 H442 H222 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.858 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.047 H132 ' H4A' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.038 H331 ' H20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.063 ' C36' H322 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.04 ' C46' H431 ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.089 H282 H461 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.044 H161 H381 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.094 ' H65' H483 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.118 ' H63' ' H8A' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.934 ' H62' ' H29' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 1.125 ' H11' H181 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 0.966 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.027 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.048 ' H55' H442 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.048 H442 ' H55' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.103 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.018 H212 ' H2 ' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.055 H132 H131 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 0.985 H241 H431 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.092 H211 ' H57' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.06 H251 H221 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.082 H483 H472 ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.941 H182 ' H40' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 0.989 H221 H242 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.06 ' H19' H451 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.066 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.092 ' H57' H211 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 0.907 ' H8 ' H162 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.118 ' H8A' ' H63' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.458 HN21 HD21 ' B' ' 120' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.054 H381 H422 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.045 H442 H483 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.061 H152 ' H39' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.044 H411 ' H52' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.06 H451 ' H19' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.1 H452 H451 ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.069 H331 ' H8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.046 H262 H451 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.062 H381 HD11 ' D' ' 460' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.025 H421 H171 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 0.95 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 0.934 ' H30' ' H39' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.069 ' H8 ' H331 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.015 ' H64' H422 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.094 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.004 H431 H222 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.562 ' HA ' HD12 ' A' ' 204' ' ' LEU . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 201' ' ' LEU . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' C' ' 550' ' ' LYS . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 232' ' ' LEU . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 228' ' ' PHE . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 241' ' ' GLN . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 241' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 237' ' ' GLU . 23.6 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.607 ' HA ' ' CZ ' ' C' ' 528' ' ' ARG . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 250' ' ' VAL . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.724 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.426 ' O ' HG12 ' A' ' 254' ' ' VAL . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.51 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.592 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.575 ' HA ' HG12 ' A' ' 276' ' ' VAL . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 274' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 274' ' ' GLN . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' C' ' 499' ' ' LEU . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.761 HD22 ' HE3' ' C' ' 495' ' ' LYS . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 283' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 279' ' ' LEU . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 291' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 291' ' ' LEU . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.502 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 298' ' ' LEU . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.558 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.648 HD22 ' HG2' ' C' ' 473' ' ' LYS . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.445 ' HG3' HD21 ' C' ' 469' ' ' LEU . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.725 ' HA ' HD12 ' A' ' 316' ' ' LEU . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 317' ' ' ARG . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.575 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.47 ' HA ' HD12 ' A' ' 331' ' ' LEU . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.55 HH21 ' HB3' ' C' ' 447' ' ' GLU . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 331' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 328' ' ' ARG . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.442 ' O ' ' HG ' ' A' ' 338' ' ' LEU . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.42 ' OD1' ' HB3' ' C' ' 432' ' ' LYS . 53.5 t30 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.448 ' HA2' ' HE ' ' A' ' 345' ' ' ARG . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 344' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 348' ' ' GLU . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' C' ' 433' ' ' GLU . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.529 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.769 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 364' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 368' ' ' LEU . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.906 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.906 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 371' ' ' LEU . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.513 HD12 HD23 ' A' ' 368' ' ' LEU . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.447 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.454 ' O ' HG23 ' A' ' 384' ' ' VAL . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 380' ' ' GLU . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.531 ' HB2' ' CE ' ' C' ' 594' ' ' LYS . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 400' ' ' LYS . . . . . 0.451 ' HB2' ' HE2' ' C' ' 400' ' ' LYS . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' C' ' 415' ' ' LEU . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' C' ' 412' ' ' PHE . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.491 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.529 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.42 ' HB3' ' OD1' ' A' ' 341' ' ' ASN . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.449 ' HG2' ' HD3' ' A' ' 345' ' ' ARG . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.55 ' HB3' HH21 ' A' ' 330' ' ' ARG . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 456' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' C' ' 456' ' ' LEU . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 459' ' ' PHE . . . . . 0.454 ' HD1' ' HA ' ' C' ' 459' ' ' PHE . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.65 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.648 ' HG2' HD22 ' A' ' 301' ' ' LEU . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.433 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.761 ' HE3' HD22 ' A' ' 279' ' ' LEU . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.494 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.509 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.73 HD21 ' HG2' ' A' ' 275' ' ' LYS . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.747 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.609 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.777 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.777 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 1.3 m-70 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.605 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.605 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.48 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.607 ' CZ ' ' HA ' ' A' ' 246' ' ' ASP . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.467 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.459 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.413 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 557' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' C' ' 560' ' ' GLU . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 560' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' C' ' 557' ' ' THR . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 562' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 563' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' C' ' 567' ' ' GLU . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' C' ' 563' ' ' LYS . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 567' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 563' ' ' LYS . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 570' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 572' ' ' GLY . . . . . 0.44 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.528 ' HA ' HG12 ' C' ' 576' ' ' VAL . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 570' ' ' ARG . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.612 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.531 ' CE ' ' HB2' ' A' ' 388' ' ' SER . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.644 ' HB2' HG22 ' B' ' 55' ' ' ILE . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' B' ' 78' ' ' PHE . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' B' ' 79' ' ' LEU . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 80' ' ' CYS . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.533 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.637 ' CA ' ' H8 ' ' B' ' 216' ' ' GNP . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.401 ' N ' ' O1B' ' B' ' 216' ' ' GNP . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.432 HG23 HD12 ' B' ' 55' ' ' ILE . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.684 HD13 ' CG1' ' D' ' 388' ' ' VAL . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.524 HG21 ' HD2' ' B' ' 40' ' ' TYR . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.658 ' HG2' ' HE2' ' B' ' 40' ' ' TYR . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.466 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.767 ' HD1' H5'1 ' B' ' 216' ' ' GNP . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' D' ' 371' ' ' ASN . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.694 ' HB3' HG23 ' D' ' 369' ' ' VAL . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' D' ' 366' ' ' GLN . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.658 ' HE2' ' HG2' ' B' ' 25' ' ' GLN . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.469 ' HB2' HH22 ' B' ' 164' ' ' ARG . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.534 HD22 HD11 ' B' ' 6' ' ' LEU . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.644 HG22 ' HB2' ' B' ' 6' ' ' LEU . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.696 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ASP . . . . . 0.445 ' HA ' ' HE2' ' B' ' 72' ' ' MET . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.696 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' B' ' 69' ' ' ASP . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.437 ' HB2' HG12 ' B' ' 103' ' ' VAL . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.798 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.744 ' HB2' HG12 ' B' ' 8' ' ' VAL . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.45 ' HA ' HG23 ' B' ' 9' ' ' VAL . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.514 HG12 ' HB ' ' B' ' 114' ' ' VAL . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.765 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.533 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.516 HD11 ' HA ' ' B' ' 118' ' ' CYS . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.765 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.412 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 89' ' ' SER . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.423 ' O ' HG23 ' B' ' 103' ' ' VAL . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.437 HG12 ' HB2' ' B' ' 73' ' ' ARG . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.798 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.448 HG13 ' HG2' ' B' ' 140' ' ' PRO . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.645 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.514 ' HB ' HG12 ' B' ' 81' ' ' VAL . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.516 ' HA ' HD11 ' B' ' 84' ' ' ILE . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.436 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.478 ' HA ' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.626 ' OD2' ' H62' ' B' ' 210' ' ' PCW . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.514 HG23 ' HE2' ' B' ' 141' ' ' PHE . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.582 ' HG3' ' O1P' ' D' ' 503' ' ' PCW . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.522 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.451 ' OE1' ' H62' ' D' ' 506' ' ' PCW . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.479 ' NH2' H341 ' D' ' 509' ' ' PCW . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.448 ' HG2' HG13 ' B' ' 112' ' ' VAL . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.514 ' HE2' HG23 ' B' ' 127' ' ' THR . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.422 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 149' ' ' ARG . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' PHE . . . . . 0.54 ' HE1' HG21 ' B' ' 55' ' ' ILE . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.722 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' B' ' 161' ' ' ARG . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.483 HG22 ' HE2' ' B' ' 167' ' ' LYS . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.469 HH22 ' HB2' ' B' ' 49' ' ' GLU . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.483 ' HE2' HG22 ' B' ' 163' ' ' ILE . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -83.23 -33.42 26.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 173' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' B' ' 176' ' ' LYS . 11.8 t70 -68.22 -49.22 62.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.605 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 63.53 -101.53 0.46 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.632 -0.587 . . . . 10.0 111.632 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 33.2 mttp -134.06 14.22 3.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.935 0.398 . . . . 10.0 110.648 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' B' ' 173' ' ' ASP . 0.0 OUTLIER -114.34 112.04 22.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.785 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -141.41 167.78 21.35 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? 73.26 119.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.284 0.564 . . . . 10.0 111.714 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -100.2 111.61 23.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.943 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 180' ' ' LYS . . . . . 0.436 ' NZ ' ' O4 ' ' A' ' 410' ' ' 17F . 20.3 tptp -90.15 92.2 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.215 0.531 . . . . 10.0 110.88 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 11.1 m -136.85 142.01 42.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.9 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.411 ' NZ ' HN1A ' A' ' 410' ' ' 17F . 37.6 mtmm -88.49 -28.69 20.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.588 0.218 . . . . 10.0 111.588 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 25.4 m 72.75 118.81 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.706 0.629 . . . . 10.0 111.314 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.524 ' HA ' ' H63' ' A' ' 410' ' ' 17F . 81.8 tttt 63.79 74.49 0.41 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.7 0.762 . . . . 10.0 110.851 -178.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 185' ' ' CYS . . . . . 0.912 ' HB3' ' H18' ' A' ' 410' ' ' 17F . 14.9 t . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.066 -0.97 . . . . 10.0 110.447 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.433 ' HG2' HG22 ' D' ' 369' ' ' VAL . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.719 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.897 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 367' ' ' ARG . . . . . 0.42 ' HG3' ' OG ' ' B' ' 39' ' ' SER . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.694 HG23 ' HB3' ' B' ' 37' ' ' GLU . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.835 ' HB2' HD11 ' B' ' 36' ' ' ILE . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 372' ' ' VAL . . . . . 0.443 HG11 ' SG ' ' D' ' 381' ' ' CYS . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 373' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' D' ' 382' ' ' LEU . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 381' ' ' CYS . . . . . 0.443 ' SG ' HG11 ' D' ' 372' ' ' VAL . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' D' ' 378' ' ' LEU . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.684 ' CG1' HD13 ' B' ' 21' ' ' ILE . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 396' ' ' CYS . . . . . 0.432 ' HB3' HG12 ' D' ' 428' ' ' VAL . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.519 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.519 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 410' ' ' ALA . . . . . 0.43 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.483 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.432 HG12 ' HB3' ' D' ' 396' ' ' CYS . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 447' ' ' LEU . . . . . 0.649 ' O ' ' H63' ' B' ' 207' ' ' PCW . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 448' ' ' LYS . . . . . 0.536 ' HG3' ' C3 ' ' B' ' 213' ' ' 17F . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 449' ' ' LEU . . . . . 0.516 HD13 ' H11' ' B' ' 207' ' ' PCW . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.704 ' HA ' HD23 ' D' ' 459' ' ' LEU . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 454' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' D' ' 476' ' ' CYS . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 458' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.781 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.451 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.451 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' D' ' 470' ' ' TYR . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.457 ' CB ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 470' ' ' TYR . . . . . 0.502 ' O ' ' HA ' ' D' ' 464' ' ' ARG . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.781 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.898 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.898 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.47 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.457 ' HB3' ' CB ' ' D' ' 468' ' ' CYS . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 0.939 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 1.002 ' H52' ' H1 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 0.968 H231 H162 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.216 ' H31' ' O1P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.111 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 1.015 H411 H361 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 0.997 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.07 H172 H212 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.053 ' H60' H432 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.966 ' H53' H281 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.037 ' H39' H151 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 1.056 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.063 ' H39' H432 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 1.086 H272 H461 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.036 H341 H141 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.047 H122 ' H11' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 0.996 H242 H242 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 1.006 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.0 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.116 ' H2 ' ' C4 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.008 H461 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.007 ' O31' ' H51' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.052 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.044 H261 ' H62' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.088 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.912 ' H63' ' O1 ' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.017 ' C6 ' H321 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.063 H432 ' H39' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.007 ' H51' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 0.929 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.153 H141 ' H9A' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.07 ' H19' H461 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.07 H461 ' H19' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.12 H412 ' H45' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 0.955 H432 H472 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 1.088 ' H2 ' ' H41' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.063 H262 ' H61' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.063 ' H61' H262 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.051 H232 H481 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.071 H412 ' H39' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.071 ' H39' H412 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.025 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.066 ' H73' H271 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.058 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 1.048 ' H39' ' H47' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 1.044 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.047 ' H11' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.12 ' H45' H412 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.153 ' H9A' H141 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 0.928 ' C31' H352 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.059 H161 H322 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.047 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.013 H471 H442 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.004 H241 H282 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.185 H283 ' C23' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 0.945 H342 H172 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.025 H262 H222 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.927 ' O11' ' H82' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 0.997 H361 ' H12' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.041 ' H20' H242 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.005 H352 ' H9A' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.081 H11A H412 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.022 ' H4 ' ' H52' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.03 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.767 H5'1 ' HD1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.051 H481 H232 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.013 H442 H471 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.026 H352 ' H82' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.091 H421 ' C16' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.11 H252 H212 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.041 H242 ' H20' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.08 H351 ' H9 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.086 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.049 ' H62' ' H2 ' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.035 ' O11' ' H51' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.001 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.111 ' H47' ' H42' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.08 ' H9 ' H351 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.111 ' H42' ' H47' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.0 H483 H211 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.043 H161 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' LEU . . . . . 0.56 HD22 HD12 ' A' ' 204' ' ' LEU . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.545 HD21 H282 ' A' ' 415' ' ' PCW . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 204' ' ' LEU . . . . . 0.56 HD12 HD22 ' A' ' 201' ' ' LEU . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 202' ' ' LYS . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 207' ' ' TRP . . . . . 0.468 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' PHE . . . . . 0.461 ' HZ ' H161 ' A' ' 402' ' ' PCW . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' A' ' 232' ' ' LEU . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.534 ' CH2' H462 ' A' ' 402' ' ' PCW . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.858 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 243' ' ' MET . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.732 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.461 ' C ' ' HB2' ' A' ' 248' ' ' GLU . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.546 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.732 HD12 ' HG3' ' A' ' 243' ' ' MET . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.461 ' HB2' ' C ' ' A' ' 244' ' ' SER . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.773 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.526 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.773 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.418 ' HG ' HG22 ' A' ' 254' ' ' VAL . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 259' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.408 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.559 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 266' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 270' ' ' GLU . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 266' ' ' GLN . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.624 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 293' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.455 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.525 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.665 HD13 ' HG2' ' C' ' 473' ' ' LYS . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.619 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.514 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 324' ' ' SER . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 330' ' ' ARG . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.553 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.417 ' HG2' ' OD1' ' C' ' 429' ' ' ASN . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 349' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 349' ' ' TYR . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 351' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 353' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 355' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 368' ' ' LEU . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 374' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 378' ' ' VAL . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 378' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 374' ' ' GLY . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.435 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 388' ' ' SER . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.528 ' O ' HG23 ' C' ' 408' ' ' VAL . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.528 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 412' ' ' PHE . . . . . 0.563 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 421' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.417 ' OD1' ' HG2' ' A' ' 345' ' ' ARG . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 433' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 437' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 441' ' ' MET . . . . . 0.47 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.512 ' HD2' H283 ' C' ' 601' ' ' PCW . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.808 ' HB3' H281 ' C' ' 602' ' ' PCW . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.672 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.87 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.665 ' HG2' HD13 ' A' ' 301' ' ' LEU . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 477' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' C' ' 477' ' ' LEU . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 492' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.431 ' HE3' HD22 ' A' ' 279' ' ' LEU . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.423 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.836 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.836 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.47 HD21 ' HG2' ' A' ' 275' ' ' LYS . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.423 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.673 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.673 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.581 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.559 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.48 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.413 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.473 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.665 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.473 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.665 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 518' ' ' LEU . . . . . 0.428 ' HG ' HD22 ' C' ' 514' ' ' LEU . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.65 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.578 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' C' ' 528' ' ' ARG . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.578 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 529' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 538' ' ' GLU . . . . . 0.402 ' HA ' ' OE2' ' C' ' 538' ' ' GLU . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.628 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.846 HD21 H281 ' A' ' 402' ' ' PCW . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' C' ' 577' ' ' LEU . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.812 HD22 ' HE3' ' C' ' 581' ' ' LYS . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.403 ' O ' HG23 ' C' ' 582' ' ' VAL . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 581' ' ' LYS . . . . . 0.812 ' HE3' HD22 ' C' ' 577' ' ' LEU . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.403 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 590' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' C' ' 593' ' ' LYS . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' C' ' 590' ' ' GLU . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.435 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' B' ' 55' ' ' ILE . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.419 HG11 HD11 ' B' ' 100' ' ' ILE . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLY . . . . . 0.449 ' N ' ' O2B' ' B' ' 216' ' ' GNP . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.705 ' HA2' ' H8 ' ' B' ' 216' ' ' GNP . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.763 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' D' ' 370' ' ' VAL . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.847 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 41' ' ' ARG . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' D' ' 468' ' ' CYS . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.481 HD22 HD11 ' B' ' 6' ' ' LEU . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' B' ' 6' ' ' LEU . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.599 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.622 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.622 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.744 ' HE3' HG21 ' B' ' 103' ' ' VAL . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.857 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.796 ' HG ' HD22 ' B' ' 159' ' ' LEU . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.481 ' HB2' HD12 ' B' ' 113' ' ' LEU . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.589 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.477 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.897 HD11 ' HA ' ' B' ' 118' ' ' CYS . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.578 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.419 HD11 HG11 ' B' ' 9' ' ' VAL . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.744 HG21 ' HE3' ' B' ' 72' ' ' MET . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.857 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.682 ' HB ' HD23 ' B' ' 79' ' ' LEU . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 80' ' ' CYS . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.457 HG22 ' HB ' ' B' ' 142' ' ' ILE . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.412 ' ND2' ' N7 ' ' B' ' 216' ' ' GNP . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.633 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.897 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.633 HD12 ' HB3' ' B' ' 117' ' ' LYS . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.517 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.733 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.733 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.566 ' HG2' HG13 ' B' ' 112' ' ' VAL . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' B' ' 114' ' ' VAL . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.496 ' HD3' HN21 ' B' ' 216' ' ' GNP . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ASP . . . . . 0.623 ' OD2' ' H52' ' B' ' 212' ' ' PCW . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.406 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 158' ' ' THR . . . . . 0.496 ' OG1' ' H63' ' B' ' 212' ' ' PCW . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.796 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.407 HG11 HD13 ' B' ' 46' ' ' ILE . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.452 ' NH1' ' H51' ' B' ' 212' ' ' PCW . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.606 HG22 ' HE2' ' B' ' 167' ' ' LYS . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.916 ' HB3' ' H61' ' B' ' 209' ' ' PCW . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.606 ' HE2' HG22 ' B' ' 163' ' ' ILE . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -113.05 -48.48 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 173' ' ' ASP . . . . . 0.416 ' OD2' ' HB3' ' B' ' 176' ' ' LYS . 32.5 t70 -70.01 -39.39 75.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 82.14 -83.07 1.57 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 110.994 -0.843 . . . . 10.0 110.994 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 1.4 tppm? -161.45 43.42 0.16 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.641 0.734 . . . . 10.0 109.544 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' B' ' 176' ' ' LYS . 33.6 ttpt -102.84 84.8 2.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.287 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 2.7 mmpm? -84.06 61.44 6.47 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.585 0.707 . . . . 10.0 111.235 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -111.75 80.2 1.3 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.459 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -86.44 105.68 16.93 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.43 -0.805 . . . . 10.0 110.4 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -153.47 96.09 1.99 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.458 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' SER . . . . . 0.462 ' OG ' ' H2 ' ' B' ' 201' ' ' PCW . 26.8 p -151.49 -106.96 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.921 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.993 ' HD3' ' H40' ' B' ' 201' ' ' PCW . 24.1 tttm -158.66 105.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.799 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -50.64 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.076 0.465 . . . . 10.0 111.22 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -158.95 -55.64 0.06 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.082 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.238 0.487 0 O-C-N 123.834 0.709 . . . . 10.0 110.819 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 357' ' ' THR . . . . . 0.477 ' H ' HG13 ' D' ' 422' ' ' ILE . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.571 ' HD3' ' HE1' ' D' ' 361' ' ' PHE . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 360' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' D' ' 368' ' ' THR . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 361' ' ' PHE . . . . . 0.571 ' HE1' ' HD3' ' D' ' 359' ' ' ARG . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.988 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.583 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.988 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 367' ' ' ARG . . . . . 0.487 ' HB3' ' CE2' ' D' ' 361' ' ' PHE . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.477 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.847 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 370' ' ' VAL . . . . . 0.705 ' HA ' HD12 ' B' ' 36' ' ' ILE . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 372' ' ' VAL . . . . . 0.53 HG11 ' SG ' ' D' ' 381' ' ' CYS . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 381' ' ' CYS . . . . . 0.53 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 386' ' ' LEU . . . . . 0.648 HD21 ' HD3' ' D' ' 393' ' ' PRO . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 387' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 389' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 389' ' ' ARG . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 393' ' ' PRO . . . . . 0.648 ' HD3' HD21 ' D' ' 386' ' ' LEU . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 396' ' ' CYS . . . . . 0.497 ' HB3' HG12 ' D' ' 428' ' ' VAL . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 397' ' ' ALA . . . . . 0.688 ' HB2' HD23 ' D' ' 431' ' ' LEU . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 401' ' ' LEU . . . . . 0.401 HD13 ' HB2' ' D' ' 425' ' ' GLU . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 411' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' D' ' 411' ' ' ARG . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' D' ' 412' ' ' LEU . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 422' ' ' ILE . . . . . 0.477 HG13 ' H ' ' D' ' 357' ' ' THR . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.401 ' HB2' HD13 ' D' ' 401' ' ' LEU . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 428' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' D' ' 396' ' ' CYS . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' D' ' 397' ' ' ALA . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 440' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' D' ' 465' ' ' CYS . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 442' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 444' ' ' LYS . . . . . 0.578 ' HG2' ' HD3' ' D' ' 464' ' ' ARG . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 445' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' D' ' 444' ' ' LYS . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 446' ' ' PHE . . . . . 0.621 ' O ' ' H1 ' ' D' ' 514' ' ' 17F . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 447' ' ' LEU . . . . . 0.934 HD23 ' H1A' ' D' ' 514' ' ' 17F . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.436 ' HG ' ' H ' ' D' ' 460' ' ' LEU . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.417 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 463' ' ' PHE . . . . . 0.572 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.578 ' HD3' ' HG2' ' D' ' 444' ' ' LYS . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' D' D ' 469' ' ' GLY . . . . . 0.435 ' H ' ' HB2' ' D' ' 465' ' ' CYS . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.409 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.877 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 474' ' ' GLU . . . . . 0.572 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.877 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.519 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.445 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 481' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.081 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 1.07 H221 H262 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.026 H372 H411 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 0.969 H351 H152 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.248 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 1.129 H462 H251 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.068 H431 H232 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.066 H341 ' H57' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.066 ' H57' H341 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.991 ' H32' H211 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.067 H272 H281 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 0.973 ' C3 ' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.09 H382 H151 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 1.017 ' C40' H441 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.093 H412 H231 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.021 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.03 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.959 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.025 H142 H381 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.064 ' H2 ' ' H41' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.07 H272 ' H77' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.118 H171 H342 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.114 ' H61' H281 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.043 H431 ' H34' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 0.989 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.825 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.088 ' O2P' ' H63' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.108 H212 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.118 H342 H171 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 1.054 H242 H483 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.089 H221 H251 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.056 ' H39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.049 H412 H362 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.061 H422 H261 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.088 ' H63' ' O2P' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.884 H141 ' O9 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.025 H421 ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.017 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.107 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.06 ' H31' ' H32' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.114 H281 ' H61' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.061 H261 H422 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.043 ' H34' H431 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.149 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 1.015 ' H67' ' H39' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 0.916 ' H51' ' H57' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.021 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.02 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 0.893 ' H51' H442 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.017 H211 H231 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.256 H362 ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.037 H252 H151 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.06 H121 H342 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.018 ' H52' H10A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.078 H372 ' H34' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.089 H251 H221 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.06 H342 H121 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 1.006 H122 H152 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.051 H261 H252 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.068 H232 H431 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.028 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.078 ' H34' H372 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.018 H10A ' H52' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.035 ' H29' ' H71' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.763 ' O1G' ' HB3' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.096 H332 ' H37' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.03 H262 H411 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.051 H252 H261 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.067 H281 H272 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.075 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.129 H251 H462 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 0.95 H351 ' H8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.081 ' H2 ' ' H62' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.036 ' H51' ' C1 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.029 H342 H283 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.048 ' H43' H221 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.096 ' H37' H332 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 0.95 ' H8 ' H351 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.07 ' H77' H272 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.093 H231 H412 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.017 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.662 HD21 H282 ' A' ' 415' ' ' PCW . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.45 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' GLN . . . . . 0.418 HE22 ' CD ' ' C' ' 553' ' ' GLU . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 221' ' ' LEU . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 224' ' ' VAL . . . . . 0.441 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 245' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.585 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.469 ' HA ' HG12 ' A' ' 250' ' ' VAL . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 249' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.723 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.723 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.445 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.445 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.456 ' O ' ' HD2' ' A' ' 261' ' ' PHE . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 258' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 254' ' ' VAL . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 257' ' ' TYR . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 262' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 266' ' ' GLN . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.481 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.683 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 266' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 262' ' ' GLN . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 269' ' ' MET . . . . . 0.485 ' CE ' H252 ' B' ' 201' ' ' PCW . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.514 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.536 ' HA ' HG12 ' A' ' 276' ' ' VAL . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.71 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.422 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 280' ' ' ARG . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 288' ' ' ARG . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 291' ' ' LEU . . . . . 0.423 HD23 HD12 ' A' ' 294' ' ' LEU . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.423 HD12 HD23 ' A' ' 291' ' ' LEU . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.596 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.558 HD13 ' HG2' ' C' ' 473' ' ' LYS . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.577 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' A' ' 308' ' ' ARG . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.577 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.586 ' CD2' H283 ' C' ' 602' ' ' PCW . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.622 ' HA ' HD12 ' A' ' 316' ' ' LEU . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.487 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.584 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 326' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.584 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.51 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 346' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 352' ' ' LYS . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.612 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.805 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.805 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.428 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 378' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 382' ' ' PHE . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 384' ' ' VAL . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 382' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 378' ' ' VAL . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 380' ' ' GLU . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.546 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 399' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' C' ' 399' ' ' LEU . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 403' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 406' ' ' ASP . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 406' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 403' ' ' ASP . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.518 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 411' ' ' THR . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.45 ' HA ' ' HG2' ' C' ' 425' ' ' GLU . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' C' ' 422' ' ' VAL . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.638 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 441' ' ' MET . . . . . 0.638 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 442' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' C' ' 446' ' ' GLU . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.442 ' O ' HG12 ' C' ' 448' ' ' VAL . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 446' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' C' ' 442' ' ' SER . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.442 HG12 ' O ' ' C' ' 445' ' ' LEU . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 449' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.416 HG23 HG22 ' C' ' 448' ' ' VAL . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.751 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.751 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.523 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 460' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' C' ' 460' ' ' GLN . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.558 ' HG2' HD13 ' A' ' 301' ' ' LEU . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 483' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' C' ' 486' ' ' ARG . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 486' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' C' ' 483' ' ' GLU . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 488' ' ' LYS . . . . . 0.433 ' HA ' ' OE1' ' C' ' 491' ' ' GLU . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' C' ' 488' ' ' LYS . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.697 ' HE3' HD22 ' A' ' 279' ' ' LEU . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.478 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.419 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.684 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.684 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.683 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.634 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.426 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.856 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 513' ' ' ALA . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.856 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.419 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.647 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.447 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 524' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' C' ' 522' ' ' SER . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.585 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.549 HD23 HD12 ' C' ' 536' ' ' LEU . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.436 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.549 HD12 HD23 ' C' ' 533' ' ' LEU . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' C' ' 544' ' ' LEU . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.601 ' HA ' ' HB2' ' C' ' 546' ' ' GLU . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' C' ' 540' ' ' GLY . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' C' ' 543' ' ' ARG . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.418 ' CD ' HE22 ' A' ' 220' ' ' GLN . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' C' ' 558' ' ' LEU . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 559' ' ' SER . . . . . 0.474 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 562' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 568' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 575' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' C' ' 577' ' ' LEU . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 580' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.704 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.599 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.521 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' B' ' 79' ' ' LEU . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.423 HG21 HD11 ' B' ' 100' ' ' ILE . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HG3' ' B' ' 61' ' ' GLN . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.54 ' HA3' ' C8 ' ' B' ' 216' ' ' GNP . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.4 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' SER . . . . . 0.425 ' OG ' ' O2G' ' B' ' 216' ' ' GNP . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.429 HG22 ' HD1' ' B' ' 40' ' ' TYR . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.805 HD13 HG13 ' D' ' 388' ' ' VAL . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.593 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.523 ' HD1' H5'2 ' B' ' 216' ' ' GNP . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.661 HD11 ' HB2' ' D' ' 371' ' ' ASN . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.652 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' B' ' 20' ' ' THR . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.416 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' CYS . . . . . 0.416 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.644 HD11 ' HG3' ' B' ' 37' ' ' GLU . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.4 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' HA3' ' B' ' 12' ' ' GLY . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' B' ' 68' ' ' ARG . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.554 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.825 ' HG ' HD22 ' B' ' 159' ' ' LEU . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.405 ' HB2' HD12 ' B' ' 113' ' ' LEU . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.749 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.542 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.975 HD11 ' HA ' ' B' ' 118' ' ' CYS . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.542 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.749 HD11 ' HB3' ' B' ' 82' ' ' PHE . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.515 ' O ' HG23 ' B' ' 103' ' ' VAL . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.423 HD11 HG21 ' B' ' 9' ' ' VAL . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' B' ' 107' ' ' GLU . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 99' ' ' GLN . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLU . . . . . 0.468 ' HA ' ' HE3' ' B' ' 101' ' ' LYS . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.554 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.683 ' HB ' HD23 ' B' ' 79' ' ' LEU . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 80' ' ' CYS . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.592 ' HB ' HG12 ' B' ' 81' ' ' VAL . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 144' ' ' THR . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.593 ' HG2' ' C6 ' ' B' ' 216' ' ' GNP . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.975 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' B' ' 117' ' ' LYS . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.517 ' HG3' HD12 ' B' ' 84' ' ' ILE . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.693 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.654 ' HB ' ' H82' ' C' ' 602' ' ' PCW . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.663 ' HB2' ' H63' ' C' ' 602' ' ' PCW . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.693 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.603 ' OE1' ' H51' ' C' ' 602' ' ' PCW . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.43 ' HE2' HG23 ' B' ' 127' ' ' THR . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.593 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ASP . . . . . 0.533 ' OD1' ' H52' ' B' ' 212' ' ' PCW . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.461 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.825 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.516 ' NH1' ' H51' ' B' ' 212' ' ' PCW . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.436 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.462 ' HE2' ' O4P' ' B' ' 206' ' ' PCW . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.808 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.808 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 38.0 mtmt -95.32 -27.98 15.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.19 -50.37 6.03 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.749 0.309 . . . . 10.0 110.655 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.6 -136.94 26.65 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.699 -0.682 . . . . 10.0 113.104 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -124.03 41.53 3.47 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.453 0.644 . . . . 10.0 109.699 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.415 ' HE3' ' HB2' ' B' ' 176' ' ' LYS . 23.0 mtmt -127.96 105.74 8.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.297 -0.865 . . . . 10.0 109.282 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 135.16 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.909 0.385 . . . . 10.0 111.459 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 178' ' ' LYS . . . . . 0.528 ' HE2' ' H63' ' B' ' 201' ' ' PCW . 4.7 pttm -135.22 -79.39 0.44 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.884 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.41 -163.55 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 O-C-N 123.454 0.471 . . . . 10.0 111.7 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 180' ' ' LYS . . . . . 0.685 ' HG2' H222 ' A' ' 403' ' ' PCW . 8.3 mptt -144.3 151.36 39.27 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.714 -0.847 . . . . 10.0 108.714 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 42.9 m -147.05 113.36 5.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.352 0.12 . . . . 10.0 110.998 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? 72.94 107.43 0.07 Allowed 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.78 0.675 . . . . 10.0 111.446 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 183' ' ' THR . . . . . 0.643 HG21 H242 ' A' ' 403' ' ' PCW . 15.1 t -140.14 138.23 35.06 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.771 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -158.29 101.72 1.73 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.172 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 185' ' ' CYS . . . . . 0.819 ' SG ' H481 ' C' ' 619' ' ' PCW . 40.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.985 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' D' ' 425' ' ' GLU . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 361' ' ' PHE . . . . . 0.411 ' HB3' ' HG3' ' D' ' 427' ' ' GLN . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.813 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.599 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.813 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 367' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 367' ' ' ARG . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.652 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.661 ' HB2' HD11 ' B' ' 36' ' ' ILE . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 373' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 373' ' ' ARG . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.488 HD12 ' HB ' ' D' ' 416' ' ' THR . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 382' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' D' ' 386' ' ' LEU . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 386' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' D' ' 382' ' ' LEU . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.805 HG13 HD13 ' B' ' 21' ' ' ILE . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 389' ' ' ARG . . . . . 0.529 ' NH2' ' HG2' ' D' ' 366' ' ' GLN . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 395' ' ' CYS . . . . . 0.462 ' HA ' ' CD2' ' D' ' 431' ' ' LEU . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.567 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.641 ' HA ' ' HG ' ' D' ' 426' ' ' LEU . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 401' ' ' LEU . . . . . 0.601 HD13 ' HG3' ' D' ' 425' ' ' GLU . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.418 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.567 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 410' ' ' ALA . . . . . 0.457 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' D' ' 412' ' ' LEU . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.488 ' HB ' HD12 ' D' ' 378' ' ' LEU . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 424' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' D' ' 401' ' ' LEU . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' D' ' 400' ' ' ARG . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 427' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' D' ' 361' ' ' PHE . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.462 ' CD2' ' HA ' ' D' ' 395' ' ' CYS . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 439' ' ' HIS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 449' ' ' LEU . . . . . 0.505 ' HB2' ' H62' ' D' ' 501' ' ' PCW . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.801 ' HA ' HD23 ' D' ' 459' ' ' LEU . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 458' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.712 HD13 H121 ' D' ' 501' ' ' PCW . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.808 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.748 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 473' ' ' HIS . . . . . 0.477 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.748 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.695 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.056 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 0.981 H231 H262 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.088 ' H82' ' H11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.094 H351 H162 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.258 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.863 H411 ' C38' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.094 H162 H351 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.002 H341 ' H59' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.041 ' H29' ' H39' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 1.047 ' H1 ' ' H63' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.061 H362 H371 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 1.105 H431 H472 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.091 H431 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 1.085 H271 H271 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.048 H431 ' H19' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.077 H122 ' H9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.17 H322 ' O31' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.975 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.069 H131 ' H60' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.049 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.078 H451 H181 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.109 H182 H362 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.078 H181 H451 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.023 H431 ' H34' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 0.812 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.927 H283 ' H68' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.067 ' H19' H371 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.095 H212 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.109 H362 H182 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 1.078 H442 ' H20' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.026 H452 H262 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.118 H441 H232 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 0.996 H272 H232 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.08 H131 H151 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.078 ' H20' H442 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.847 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.114 H421 ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.066 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.17 ' O31' H322 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.039 H461 ' H40' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.105 H472 H431 ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.118 H232 H441 ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.028 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.095 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.801 ' H67' ' C23' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 0.867 ' H51' ' H57' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.077 ' H9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 0.996 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.014 ' H41' H211 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.048 H342 H121 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.062 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.066 H283 H20A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.027 H151 H341 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.098 ' H52' H10A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.094 H412 H11A ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.026 H262 H452 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.094 ' H32' ' O4P' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 1.088 ' H11' ' H82' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.056 ' C22' H242 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.024 H231 H271 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.012 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.094 H11A H412 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.098 H10A ' H52' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.114 ' H62' H421 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.763 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . 0.763 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.06 ' H39' H441 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.047 ' H63' ' H1 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 0.999 H251 H211 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.053 H122 H171 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.017 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 0.994 H242 ' H20' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 0.958 H242 H472 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.091 H382 H232 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.066 ' H63' H321 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.066 H321 ' H63' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.045 ' H51' H212 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 0.963 ' H33' ' H2 ' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 0.983 ' H12' ' H65' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 0.929 ' H78' H242 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.049 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.066 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 202' ' ' LYS . . . . . 0.596 ' HE3' H282 ' A' ' 415' ' ' PCW . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 210' ' ' VAL . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 206' ' ' ASN . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' ARG . . . . . 0.402 ' HA ' HD12 ' A' ' 221' ' ' LEU . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 218' ' ' ARG . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.544 ' HZ ' H483 ' A' ' 402' ' ' PCW . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.797 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 232' ' ' LEU . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.416 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.797 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.471 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.936 ' HG3' HD12 ' A' ' 247' ' ' LEU . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 244' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 248' ' ' GLU . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.451 ' O ' ' HB ' ' A' ' 250' ' ' VAL . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.936 HD12 ' HG3' ' A' ' 243' ' ' MET . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 248' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' A' ' 244' ' ' SER . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.713 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.433 ' O ' HG12 ' A' ' 254' ' ' VAL . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.552 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 257' ' ' TYR . . . . . 0.42 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 261' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 263' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.553 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.453 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 270' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.585 ' HA ' HG12 ' A' ' 276' ' ' VAL . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 274' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.723 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 273' ' ' ARG . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.764 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.764 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.799 HD22 ' HE3' ' C' ' 495' ' ' LYS . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 290' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.769 HD13 ' HG2' ' C' ' 473' ' ' LYS . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 305' ' ' MET . . . . . 0.43 ' SD ' HD13 ' C' ' 469' ' ' LEU . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.559 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 308' ' ' ARG . . . . . 0.671 ' HG3' HD21 ' C' ' 469' ' ' LEU . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 313' ' ' VAL . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 313' ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' ' 316' ' ' LEU . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 314' ' ' ASP . . . . . 0.411 ' HA ' ' NH1' ' A' ' 317' ' ' ARG . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.459 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 314' ' ' ASP . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.429 HD23 ' HD2' ' A' ' 330' ' ' ARG . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.78 HH21 ' HB3' ' C' ' 447' ' ' GLU . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 338' ' ' LEU . . . . . 0.412 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 342' ' ' GLY . . . . . 0.412 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 343' ' ' GLY . . . . . 0.407 ' HA2' HD12 ' A' ' 346' ' ' LEU . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 346' ' ' LEU . . . . . 0.407 HD12 ' HA2' ' A' ' 343' ' ' GLY . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.748 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.748 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 357' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 357' ' ' LEU . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 359' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' C' ' 414' ' ' LYS . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 361' ' ' SER . . . . . 0.656 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.402 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.981 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.981 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 368' ' ' LEU . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 375' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 379' ' ' LEU . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 377' ' ' PRO . . . . . 0.467 ' HG2' ' HE3' ' C' ' 400' ' ' LYS . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 379' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 376' ' ' LEU . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 383' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 386' ' ' PHE . . . . . 0.621 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.659 ' HB2' ' HE3' ' C' ' 594' ' ' LYS . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 389' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 393' ' ' TYR . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 392' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 388' ' ' SER . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 393' ' ' TYR . . . . . 0.458 ' HD2' ' O ' ' A' ' 389' ' ' ALA . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 400' ' ' LYS . . . . . 0.467 ' HE3' ' HG2' ' A' ' 377' ' ' PRO . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 402' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 405' ' ' TRP . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.41 ' O ' HG23 ' C' ' 408' ' ' VAL . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 405' ' ' TRP . . . . . 0.447 ' HB2' ' HA ' ' C' ' 402' ' ' LEU . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 413' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.513 ' HB3' ' CG2' ' A' ' 359' ' ' THR . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' C' ' 413' ' ' SER . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.436 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.741 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.463 ' O ' HG12 ' C' ' 448' ' ' VAL . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.78 ' HB3' HH21 ' A' ' 330' ' ' ARG . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.769 HG22 HG23 ' C' ' 452' ' ' VAL . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 449' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.769 HG23 HG22 ' C' ' 448' ' ' VAL . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 458' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' C' ' 458' ' ' ASP . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 463' ' ' TRP . . . . . 0.435 ' O ' ' HB2' ' C' ' 467' ' ' MET . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 464' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 467' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 468' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.618 ' HA ' ' HG2' ' C' ' 475' ' ' GLU . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.769 ' HG2' HD13 ' A' ' 301' ' ' LEU . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.618 ' HG2' ' HA ' ' C' ' 471' ' ' ARG . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.68 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 482' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 487' ' ' GLN . . . . . 0.501 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 491' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.799 ' HE3' HD22 ' A' ' 279' ' ' LEU . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' C' ' 501' ' ' GLU . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 501' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' C' ' 497' ' ' SER . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.567 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.461 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.553 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.571 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.805 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.805 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.692 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.48 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 533' ' ' LEU . . . . . 0.67 HD23 HD12 ' C' ' 536' ' ' LEU . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.67 HD12 HD23 ' C' ' 533' ' ' LEU . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.513 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 542' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 546' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' C' ' 542' ' ' ALA . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 568' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' C' ' 576' ' ' VAL . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.444 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 578' ' ' GLU . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.506 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.659 ' HE3' ' HB2' ' A' ' 388' ' ' SER . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.486 ' HB ' ' HE2' ' B' ' 4' ' ' TYR . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.697 ' HG3' HD22 ' B' ' 52' ' ' LEU . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' TYR . . . . . 0.486 ' HE2' ' HB ' ' B' ' 2' ' ' THR . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.602 HD22 HD23 ' B' ' 159' ' ' LEU . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.463 HG11 ' HG3' ' B' ' 72' ' ' MET . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.436 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.474 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.601 HD13 ' CG1' ' D' ' 388' ' ' VAL . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.533 HD22 HG12 ' B' ' 152' ' ' VAL . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ILE . . . . . 0.416 HD12 ' HB2' ' B' ' 42' ' ' LYS . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' HIS . . . . . 0.454 ' O ' HG22 ' B' ' 21' ' ' ILE . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PHE . . . . . 0.437 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.412 ' HD1' H5'2 ' B' ' 216' ' ' GNP . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.784 ' HB2' ' CG2' ' D' ' 369' ' ' VAL . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LYS . . . . . 0.416 ' HB2' HD12 ' B' ' 24' ' ' ILE . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.56 ' HA ' ' HD2' ' D' ' 448' ' ' LYS . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' GLY . . . . . 0.611 ' HA2' ' CB ' ' D' ' 450' ' ' ALA . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 49' ' ' GLU . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.697 HD22 ' HG3' ' B' ' 3' ' ' GLU . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.542 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.463 ' HG3' HG11 ' B' ' 7' ' ' VAL . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.622 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.548 ' HG ' HD22 ' B' ' 159' ' ' LEU . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.412 ' HB2' HD12 ' B' ' 113' ' ' LEU . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' B' ' 93' ' ' ILE . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.543 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.994 HD11 ' HA ' ' B' ' 118' ' ' CYS . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.543 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' ASN . . . . . 0.489 HD21 ' HB3' ' B' ' 88' ' ' LYS . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LYS . . . . . 0.489 ' HB3' HD21 ' B' ' 86' ' ' ASN . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.779 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 101' ' ' LYS . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.439 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.597 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 144' ' ' THR . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.442 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.994 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.424 HD12 ' HB3' ' B' ' 117' ' ' LYS . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.486 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PHE . . . . . 0.486 ' HE2' HG23 ' B' ' 127' ' ' THR . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.48 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.511 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' VAL . . . . . 0.533 HG12 HD22 ' B' ' 23' ' ' LEU . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.426 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.602 HD23 HD22 ' B' ' 6' ' ' LEU . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' B' ' 161' ' ' ARG . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 164' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 164' ' ' ARG . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' HIS . . . . . 0.435 ' O ' ' HG2' ' B' ' 170' ' ' MET . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 170' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 166' ' ' HIS . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.456 ' HE3' ' HB2' ' B' ' 172' ' ' LYS . 34.7 mtmt -93.25 -41.85 9.66 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -78.57 -55.75 4.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.352 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 95.97 27.46 10.24 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.841 -0.695 . . . . 10.0 112.225 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm 62.78 48.81 3.97 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 176' ' ' LYS . 12.7 mmmm -88.4 -49.64 6.81 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.888 -0.325 . . . . 10.0 110.719 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? 56.61 62.2 2.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.86 -0.609 . . . . 10.0 111.44 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -79.85 62.89 4.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.198 0.523 . . . . 10.0 110.745 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -97.74 -35.93 10.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.844 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -69.77 -42.21 74.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.047 0.451 . . . . 10.0 110.707 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.01 110.38 18.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.246 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' B' ' 182' ' ' LYS . 1.2 mmmp? -92.83 12.76 22.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.378 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.28 136.18 54.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.431 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.459 ' HB3' H172 ' B' ' 201' ' ' PCW . 49.9 mtmt -60.17 122.45 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 10.0 110.773 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 185' ' ' CYS . . . . . 0.544 ' HB2' H131 ' B' ' 201' ' ' PCW . 3.8 m . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.181 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 356' ' ' ASN . . . . . 0.474 ' HA ' HD12 ' D' ' 422' ' ' ILE . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 357' ' ' THR . . . . . 0.461 ' H ' HG13 ' D' ' 422' ' ' ILE . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.827 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.827 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 367' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 367' ' ' ARG . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.784 ' CG2' ' HB2' ' B' ' 37' ' ' GLU . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' D' ' 416' ' ' THR . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 379' ' ' HIS . . . . . 0.642 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.601 ' CG1' HD13 ' B' ' 21' ' ' ILE . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 389' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 391' ' ' LEU . . . . . 0.508 HD13 ' HZ ' ' D' ' 430' ' ' PHE . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 397' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 398' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' D' ' 411' ' ' ARG . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.497 ' CE2' ' HB3' ' D' ' 429' ' ' ASP . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 401' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' D' ' 425' ' ' GLU . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.527 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.439 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 411' ' ' ARG . . . . . 0.445 ' HD3' ' HB1' ' D' ' 397' ' ' ALA . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 414' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.504 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 422' ' ' ILE . . . . . 0.474 HD12 ' HA ' ' D' ' 356' ' ' ASN . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.525 ' HB2' HD13 ' D' ' 401' ' ' LEU . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.49 HD22 HD22 ' D' ' 378' ' ' LEU . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 429' ' ' ASP . . . . . 0.497 ' HB3' ' CE2' ' D' ' 399' ' ' PHE . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 430' ' ' PHE . . . . . 0.52 ' HE2' ' HG3' ' D' ' 363' ' ' PRO . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 431' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 436' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' D' ' 436' ' ' LEU . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 439' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 442' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 446' ' ' PHE . . . . . 0.447 ' CZ ' HD12 ' D' ' 459' ' ' LEU . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 448' ' ' LYS . . . . . 0.56 ' HD2' ' HA ' ' B' ' 47' ' ' ASP . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 450' ' ' ALA . . . . . 0.611 ' CB ' ' HA2' ' B' ' 48' ' ' GLY . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.503 ' CA ' HD23 ' D' ' 459' ' ' LEU . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 454' ' ' ILE . . . . . 0.485 HD11 ' HE2' ' D' ' 470' ' ' TYR . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.503 HD23 ' CA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' D' ' 442' ' ' ALA . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 470' ' ' TYR . . . . . 0.485 ' HE2' HD11 ' D' ' 454' ' ' ILE . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.4 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.903 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.563 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.441 HG12 ' O ' ' D' ' 476' ' ' CYS . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.08 ' H39' H271 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 1.021 H281 H221 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.065 ' H41' ' H40' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.035 H152 H211 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.247 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 1.065 ' H40' ' H41' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.098 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.048 H121 ' H33' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.048 ' H33' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.654 ' H76' H452 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.021 H451 H242 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 0.98 ' H12' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.021 H221 H281 ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 1.06 H281 H271 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.007 ' H11' H411 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.023 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.051 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 1.002 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.076 H142 H381 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.136 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.072 ' O4P' ' H31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.021 H472 H432 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.114 ' H73' ' H19' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.043 ' H41' H222 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.079 H251 ' H70' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 0.773 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.037 ' H19' H371 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.022 H332 H132 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.014 H212 ' H51' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 0.99 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.093 ' H42' ' H2 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 0.89 ' P ' ' H31' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.035 H471 H431 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 0.948 H381 H161 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.021 H432 H472 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 0.986 ' H20' H10A ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.107 ' H32' ' O1P' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.113 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.089 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.058 H462 H431 ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.114 ' H19' ' H73' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.061 H241 H451 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.079 ' H70' H251 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.12 ' C7 ' H18A ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 1.089 ' H33' H141 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 1.039 ' H70' ' H36' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.023 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 0.832 ' H51' H281 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 0.986 H10A ' H20' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.005 H162 H211 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.176 H362 ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.179 H212 ' C32' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.059 ' C19' H231 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 0.883 ' H52' ' H9 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.08 ' H31' ' O1P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 0.826 H322 ' H51' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.179 ' C32' H212 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 1.017 H262 H482 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.035 H211 H152 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.058 H261 H221 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.061 H272 ' H61' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.027 H20A H142 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 0.93 ' H2 ' ' H42' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.054 ' H35' ' H78' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.48 ' N1 ' ' HB2' ' B' ' 147' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.031 ' H62' ' H2 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.08 H271 ' H39' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 0.979 H332 ' H82' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.031 H262 H222 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.114 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.13 ' H32' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 0.963 H242 H482 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.073 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.031 ' H2 ' ' H62' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.004 H471 H152 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.014 ' H51' H212 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.061 ' H61' H272 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.054 ' H38' H431 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 0.986 ' H43' H242 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.136 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.113 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 203' ' ' LEU . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' SER . . . . . 0.406 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 215' ' ' SER . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 26.9 tp60 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.561 HD21 H212 ' A' ' 402' ' ' PCW . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 225' ' ' THR . . . . . 0.546 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 228' ' ' PHE . . . . . 0.459 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 229' ' ' TRP . . . . . 0.594 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.762 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 232' ' ' LEU . . . . . 0.516 HD21 H483 ' A' ' 402' ' ' PCW . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.762 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.649 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.565 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.649 HD12 ' HG3' ' A' ' 243' ' ' MET . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.706 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.706 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.465 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.427 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 267' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 271' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.545 ' HA ' HG12 ' A' ' 276' ' ' VAL . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.667 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 273' ' ' ARG . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.491 ' HA ' HD12 ' A' ' 283' ' ' LEU . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 281' ' ' ALA . . . . . 0.547 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 282' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 283' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 280' ' ' ARG . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 285' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 294' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.493 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.502 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 307' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 310' ' ' ARG . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 307' ' ' ASP . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 316' ' ' LEU . . . . . 0.408 HD21 ' HE3' ' C' ' 462' ' ' LYS . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 320' ' ' LEU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.445 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 323' ' ' TYR . . . . . 0.46 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 329' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 330' ' ' ARG . . . . . 0.628 HH21 ' HB3' ' C' ' 447' ' ' GLU . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 334' ' ' ARG . . . . . 0.416 ' HD3' HH11 ' A' ' 334' ' ' ARG . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.482 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 360' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 363' ' ' LYS . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.462 ' HG3' ' HE3' ' C' ' 414' ' ' LYS . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.683 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.918 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.918 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 371' ' ' LEU . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 369' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 371' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 368' ' ' LEU . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.413 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.443 ' O ' HG23 ' A' ' 384' ' ' VAL . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 380' ' ' GLU . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' LYS . . . . . 0.584 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 404' ' ' ASN . . . . . 0.473 ' O ' HG23 ' C' ' 408' ' ' VAL . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 408' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 404' ' ' ASN . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.462 ' HE3' ' HG3' ' A' ' 362' ' ' GLU . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' C' ' 419' ' ' LEU . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 419' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' C' ' 416' ' ' ARG . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.482 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.597 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 445' ' ' LEU . . . . . 0.454 ' O ' HG12 ' C' ' 448' ' ' VAL . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.628 ' HB3' HH21 ' A' ' 330' ' ' ARG . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.597 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 449' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.454 HG23 ' O ' ' C' ' 448' ' ' VAL . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 453' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 464' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 466' ' ' GLU . . . . . 0.538 ' OE2' H262 ' C' ' 602' ' ' PCW . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 468' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.888 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.484 ' NZ ' HD22 ' C' ' 469' ' ' LEU . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.888 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 476' ' ' PRO . . . . . 0.675 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 489' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 493' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.566 ' HA ' HD13 ' C' ' 499' ' ' LEU . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.478 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' C' ' 495' ' ' LYS . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 501' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 497' ' ' SER . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.649 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.584 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.546 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.649 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.546 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.427 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 510' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.452 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.509 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 517' ' ' HIS . . . . . 0.473 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.711 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 521' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 522' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 523' ' ' ASP . . . . . 0.804 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 526' ' ' ARG . . . . . 0.804 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.565 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 529' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 532' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.785 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 535' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 537' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 539' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 543' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 549' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 553' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.404 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 6.9 t-80 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 555' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' C' ' 558' ' ' LEU . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 558' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' C' ' 555' ' ' LEU . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 561' ' ' LYS . . . . . 0.531 ' HB2' ' HZ2' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 566' ' ' LEU . . . . . 0.407 HD23 HD12 ' C' ' 569' ' ' LEU . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 569' ' ' LEU . . . . . 0.407 HD12 HD23 ' C' ' 566' ' ' LEU . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 573' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' C' ' 577' ' ' LEU . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 574' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' C' ' 578' ' ' GLU . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 577' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 587' ' ' ALA . . . . . 0.584 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 589' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 593' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' VAL . . . . . 0.413 ' N ' ' O2B' ' B' ' 216' ' ' GNP . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.49 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.744 HD23 ' HB2' ' B' ' 146' ' ' ALA . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.515 HD13 HG13 ' D' ' 388' ' ' VAL . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' VAL . . . . . 0.442 HG23 " O2'" ' B' ' 216' ' ' GNP . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.489 ' HE1' ' PG ' ' B' ' 216' ' ' GNP . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.676 HD11 ' HB2' ' D' ' 371' ' ' ASN . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.787 ' HB3' HG23 ' D' ' 369' ' ' VAL . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' VAL . . . . . 0.55 HG12 HH22 ' D' ' 464' ' ' ARG . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.655 HG21 HG21 ' B' ' 160' ' ' VAL . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.481 ' H ' ' HE1' ' B' ' 157' ' ' TYR . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.49 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.499 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLU . . . . . 0.429 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.642 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.642 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.457 ' HE3' HG21 ' B' ' 103' ' ' VAL . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.482 ' HB2' ' HG3' ' B' ' 111' ' ' MET . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' B' ' 112' ' ' VAL . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' B' ' 113' ' ' LEU . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.8 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.437 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.643 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.437 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.704 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.8 HD11 ' HB3' ' B' ' 82' ' ' PHE . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' ARG . . . . . 0.415 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.415 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.457 HG21 ' HE3' ' B' ' 72' ' ' MET . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.482 ' HG3' ' HB2' ' B' ' 78' ' ' PHE . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 112' ' ' VAL . . . . . 0.607 HG22 ' HG2' ' B' ' 140' ' ' PRO . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 80' ' ' CYS . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 142' ' ' ILE . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.422 ' HG2' ' C6 ' ' B' ' 216' ' ' GNP . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.452 ' HA ' HD11 ' B' ' 84' ' ' ILE . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD13 ' B' ' 84' ' ' ILE . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.502 ' HE2' H332 ' A' ' 402' ' ' PCW . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.471 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.607 ' HG2' HG22 ' B' ' 112' ' ' VAL . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ILE . . . . . 0.734 HD12 ' H62' ' B' ' 210' ' ' PCW . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.744 ' HB2' HD23 ' B' ' 19' ' ' LEU . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ASP . . . . . 0.705 ' HA ' ' HD2' ' B' ' 157' ' ' TYR . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 157' ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' B' ' 154' ' ' ASP . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' LEU . . . . . 0.445 ' O ' HG13 ' B' ' 163' ' ' ILE . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 160' ' ' VAL . . . . . 0.655 HG21 HG21 ' B' ' 46' ' ' ILE . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' LYS . . . . . 0.567 ' HD2' ' H63' ' D' ' 507' ' ' PCW . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.4 ' OE2' ' H82' ' D' ' 504' ' ' PCW . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.677 ' HG3' ' H82' ' B' ' 202' ' ' PCW . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.908 ' HB3' ' H1 ' ' A' ' 409' ' ' 17F . 41.2 mtmt -67.59 -38.32 83.84 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -77.28 -55.54 5.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.725 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 80.8 -114.12 3.77 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.098 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -112.92 -160.89 0.73 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.817 0.341 . . . . 10.0 110.682 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.26 143.29 48.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.213 0.53 . . . . 10.0 111.745 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -159.21 141.99 14.18 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.16 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 178' ' ' LYS . . . . . 0.43 ' HE3' ' HB3' ' B' ' 178' ' ' LYS . 18.6 ttpp -71.09 102.54 2.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -132.67 101.18 5.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.62 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -63.16 102.24 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.791 0.682 . . . . 10.0 109.958 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.0 m -106.85 106.72 17.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.59 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 182' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' B' ' 182' ' ' LYS . 31.7 ttpt -149.38 131.2 15.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.153 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.0 t -97.54 153.46 18.15 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.554 ' HD3' ' C28' ' A' ' 411' ' ' PCW . 4.6 mmtp 63.93 -151.24 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.295 0.372 . . . . 10.0 111.18 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 185' ' ' CYS . . . . . 0.492 ' H ' ' HB3' ' B' ' 184' ' ' LYS . 21.5 t . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.836 0.351 . . . . 10.0 111.005 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.502 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 362' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 363' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 366' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 368' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.676 ' HB2' HD11 ' B' ' 36' ' ' ILE . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.681 HD21 HD12 ' D' ' 421' ' ' LEU . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 379' ' ' HIS . . . . . 0.524 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.515 HG13 HD13 ' B' ' 21' ' ' ILE . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 391' ' ' LEU . . . . . 0.471 ' CD2' ' HZ ' ' D' ' 430' ' ' PHE . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' D' ' 412' ' ' LEU . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 402' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' D' ' 409' ' ' LYS . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 405' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 408' ' ' LYS . . . . . 0.454 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 409' ' ' LYS . . . . . 0.748 ' HA ' HD11 ' D' ' 402' ' ' LEU . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 411' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 411' ' ' ARG . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 412' ' ' LEU . . . . . 0.567 HD12 ' HB3' ' D' ' 400' ' ' ARG . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 413' ' ' ASP . . . . . 0.448 ' O ' HD12 ' D' ' 378' ' ' LEU . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 414' ' ' TRP . . . . . 0.524 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 421' ' ' LEU . . . . . 0.681 HD12 HD21 ' D' ' 378' ' ' LEU . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 424' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.502 ' HG2' ' HD2' ' D' ' 359' ' ' ARG . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.555 HD22 HD22 ' D' ' 378' ' ' LEU . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 430' ' ' PHE . . . . . 0.471 ' HZ ' ' CD2' ' D' ' 391' ' ' LEU . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 436' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 439' ' ' HIS . . . . . 0.446 ' CE1' ' HB3' ' D' ' 465' ' ' CYS . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 441' ' ' PHE . . . . . 0.515 ' HZ ' ' HB3' ' D' ' 477' ' ' SER . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 443' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 443' ' ' ARG . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 444' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' D' ' 444' ' ' LYS . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 452' ' ' CYS . . . . . 0.614 ' HA ' HD23 ' D' ' 459' ' ' LEU . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 454' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' D' ' 476' ' ' CYS . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 456' ' ' GLN . . . . . 0.618 ' HB3' ' C7 ' ' D' ' 508' ' ' PCW . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 458' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 459' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.487 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.487 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 463' ' ' PHE . . . . . 0.464 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 464' ' ' ARG . . . . . 0.55 HH22 HG12 ' B' ' 44' ' ' VAL . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.446 ' HB3' ' CE1' ' D' ' 439' ' ' HIS . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 468' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.721 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 473' ' ' HIS . . . . . 0.404 ' CE1' ' HB2' ' D' ' 452' ' ' CYS . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 474' ' ' GLU . . . . . 0.464 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 475' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' D' ' 479' ' ' LYS . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.721 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 477' ' ' SER . . . . . 0.515 ' HB3' ' HZ ' ' D' ' 441' ' ' PHE . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 479' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.486 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 481' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 484' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.021 H182 H221 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 1.087 ' H62' ' H18' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.03 H132 H121 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 1.021 ' H12' H381 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.164 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.903 H221 H481 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.014 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.011 H172 ' H20' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.127 ' H42' ' C18' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.983 ' H71' H252 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.033 H141 ' C33' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 1.032 ' C1 ' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.111 H411 ' C37' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 0.925 H482 H472 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.033 ' C33' H141 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.01 H122 ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.046 H451 ' H77' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 0.943 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 1.12 H462 ' H64' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 0.983 ' H2 ' ' C4 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 1.019 H381 ' H40' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 1.049 H211 H382 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.072 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 0.896 ' H19' ' H50' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 1.03 ' O31' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 1.002 ' H62' ' O1 ' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 1.052 ' H41' H342 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.031 H212 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.049 H382 H211 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 0.954 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 1.037 H161 H11A ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.033 ' H39' H161 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.024 H411 ' H11' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 1.033 H161 ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 1.016 H382 H121 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 1.028 H121 ' H4A' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.053 H141 ' H6 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.046 ' H82' ' H20' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.052 H342 ' H41' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 0.977 ' H19' H151 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.032 H372 ' C1 ' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.073 ' C4 ' ' H2 ' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.12 ' H64' H462 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.143 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.992 ' H59' H12A ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 0.932 ' H78' ' H40' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.01 ' C9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.002 ' O1 ' ' H62' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.037 H11A H161 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.03 H121 H132 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.069 H332 ' H11' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 0.899 H372 H361 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.088 H482 ' H38' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.02 ' H39' H483 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.019 H142 ' H18' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 0.963 H431 H211 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.042 H121 ' C18' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 0.941 H242 H181 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 1.021 H381 ' H12' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.055 H121 H371 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.061 H351 ' C20' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.05 ' H29' H372 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 1.042 ' C18' H121 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.053 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.489 ' PG ' ' HE1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.036 H171 H332 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.036 H332 H171 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.001 H251 H211 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 1.022 H331 ' O1 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.06 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.025 H272 H441 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.069 ' H11' H332 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.261 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.076 H242 ' H43' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 0.996 H261 H462 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.127 ' C18' ' H42' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.042 H19A ' H19' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.087 ' H18' ' H62' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.088 ' H38' H482 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.031 H211 H451 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 1.012 ' H73' ' H82' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' LEU . . . . . 0.72 HD21 H282 ' A' ' 415' ' ' PCW . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 214' ' ' PHE . . . . . 0.678 ' HD2' H282 ' A' ' 413' ' ' PCW . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 215' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 213' ' ' THR . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 215' ' ' SER . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 221' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 231' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 233' ' ' GLU . . . . . 0.622 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 234' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 236' ' ' THR . . . . . 0.622 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 237' ' ' GLU . . . . . 0.576 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 239' ' ' LEU . . . . . 0.493 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 240' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 242' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 243' ' ' MET . . . . . 0.683 ' HG3' HD12 ' A' ' 247' ' ' LEU . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 246' ' ' ASP . . . . . 0.708 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 247' ' ' LEU . . . . . 0.683 HD12 ' HG3' ' A' ' 243' ' ' MET . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 250' ' ' VAL . . . . . 0.574 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 254' ' ' VAL . . . . . 0.574 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 255' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 256' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 264' ' ' LYS . . . . . 0.659 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 265' ' ' TRP . . . . . 0.408 ' O ' ' HG2' ' A' ' 269' ' ' MET . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 269' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 265' ' ' TRP . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 272' ' ' TYR . . . . . 0.403 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 273' ' ' ARG . . . . . 0.553 ' HA ' HG12 ' A' ' 276' ' ' VAL . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 275' ' ' LYS . . . . . 0.601 ' HG2' HD21 ' C' ' 499' ' ' LEU . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 276' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 273' ' ' ARG . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 277' ' ' GLU . . . . . 0.42 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 278' ' ' PRO . . . . . 0.42 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 279' ' ' LEU . . . . . 0.842 HD22 ' HE3' ' C' ' 495' ' ' LYS . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 280' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 288' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 288' ' ' ARG . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 297' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 298' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 299' ' ' SER . . . . . 0.515 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 300' ' ' PRO . . . . . 0.515 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 301' ' ' LEU . . . . . 0.489 HD13 ' HG2' ' C' ' 473' ' ' LYS . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 302' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 303' ' ' GLU . . . . . 0.435 ' HG2' ' NH1' ' A' ' 306' ' ' ARG . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 306' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 310' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 312' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 317' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 317' ' ' ARG . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 321' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 322' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 324' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 325' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 327' ' ' LEU . . . . . 0.816 HD11 H241 ' C' ' 601' ' ' PCW . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 328' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 332' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 335' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 336' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 339' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 348' ' ' GLU . . . . . 0.505 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 352' ' ' LYS . . . . . 0.406 ' HG3' ' OE2' ' C' ' 425' ' ' GLU . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 363' ' ' LYS . . . . . 0.77 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 367' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 368' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.578 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 376' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 384' ' ' VAL . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 384' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 380' ' ' GLU . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 388' ' ' SER . . . . . 0.625 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 390' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 390' ' ' LEU . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 414' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 415' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' C' ' 411' ' ' THR . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 416' ' ' ARG . . . . . 0.46 HH11 ' HD2' ' C' ' 416' ' ' ARG . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 425' ' ' GLU . . . . . 0.406 ' OE2' ' HG3' ' A' ' 352' ' ' LYS . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 426' ' ' PHE . . . . . 0.581 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 427' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 428' ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 429' ' ' ASN . . . . . 0.505 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 430' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 431' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 432' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 435' ' ' GLU . . . . . 0.43 ' HA ' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 438' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' C' ' 435' ' ' GLU . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 439' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 440' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 443' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 444' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 447' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' C' ' 443' ' ' LYS . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 448' ' ' VAL . . . . . 0.451 HG23 ' O ' ' C' ' 444' ' ' ASP . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 451' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 452' ' ' VAL . . . . . 0.422 HG23 HG13 ' C' ' 448' ' ' VAL . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 454' ' ' PRO . . . . . 0.445 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 455' ' ' TYR . . . . . 0.615 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 457' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 461' ' ' LYS . . . . . 0.652 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 462' ' ' LYS . . . . . 0.808 ' HD2' H281 ' C' ' 602' ' ' PCW . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 465' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 469' ' ' LEU . . . . . 0.621 HD22 ' HZ3' ' C' ' 473' ' ' LYS . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 471' ' ' ARG . . . . . 0.763 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 473' ' ' LYS . . . . . 0.621 ' HZ3' HD22 ' C' ' 469' ' ' LEU . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 475' ' ' GLU . . . . . 0.763 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 478' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' C' ' 478' ' ' ARG . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 495' ' ' LYS . . . . . 0.842 ' HE3' HD22 ' A' ' 279' ' ' LEU . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 496' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 497' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 498' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 499' ' ' LEU . . . . . 0.601 HD21 ' HG2' ' A' ' 275' ' ' LYS . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 500' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 501' ' ' GLU . . . . . 0.523 ' HA ' ' HD2' ' C' ' 504' ' ' ARG . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 502' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 503' ' ' MET . . . . . 0.475 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 504' ' ' ARG . . . . . 0.523 ' HD2' ' HA ' ' C' ' 501' ' ' GLU . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 505' ' ' ASP . . . . . 0.422 ' OD1' ' HD2' ' C' ' 508' ' ' ARG . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 506' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 508' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 509' ' ' ALA . . . . . 0.659 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 511' ' ' VAL . . . . . 0.617 ' HA ' HD12 ' C' ' 514' ' ' LEU . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 512' ' ' ASP . . . . . 0.738 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 514' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' C' ' 511' ' ' VAL . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 515' ' ' ARG . . . . . 0.738 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 519' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 520' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 525' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 528' ' ' ARG . . . . . 0.708 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 529' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 530' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 534' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 536' ' ' LEU . . . . . 0.435 ' O ' ' HA3' ' C' ' 540' ' ' GLY . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 540' ' ' GLY . . . . . 0.499 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 544' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 550' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 554' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 564' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 568' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 572' ' ' GLY . . . . . 0.509 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 576' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' C' ' 572' ' ' GLY . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 578' ' ' GLU . . . . . 0.497 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 582' ' ' VAL . . . . . 0.497 HG23 ' O ' ' C' ' 578' ' ' GLU . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 585' ' ' LEU . . . . . 0.45 ' HA ' HD23 ' C' ' 585' ' ' LEU . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 591' ' ' TYR . . . . . 0.605 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 594' ' ' LYS . . . . . 0.625 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.603 ' HA ' ' HB ' ' B' ' 50' ' ' THR . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.472 HD11 HD22 ' B' ' 53' ' ' LEU . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' VAL . . . . . 0.672 HG12 ' HB2' ' B' ' 79' ' ' LEU . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.42 HG21 HD11 ' B' ' 100' ' ' ILE . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLY . . . . . 0.531 ' CA ' ' H8 ' ' B' ' 216' ' ' GNP . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.613 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.656 HG21 ' HB ' ' D' ' 388' ' ' VAL . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.767 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' B' ' 153' ' ' ASP . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' VAL . . . . . 0.508 HG12 HG11 ' D' ' 388' ' ' VAL . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' THR . . . . . 0.56 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.802 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ARG . . . . . 0.527 HH11 HD11 ' B' ' 52' ' ' LEU . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ILE . . . . . 0.715 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' B' ' 1' ' ' MET . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' CYS . . . . . 0.715 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.638 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.472 HD22 HD11 ' B' ' 6' ' ' LEU . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.63 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' TYR . . . . . 0.451 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.626 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' TYR . . . . . 0.626 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' MET . . . . . 0.448 ' CE ' HG21 ' B' ' 103' ' ' VAL . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' B' ' 73' ' ' ARG . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' B' ' 111' ' ' MET . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.672 ' HB2' HG12 ' B' ' 8' ' ' VAL . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' CYS . . . . . 0.408 ' HB3' HD12 ' B' ' 93' ' ' ILE . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.633 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' PHE . . . . . 0.71 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ALA . . . . . 0.475 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' B' ' 118' ' ' CYS . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ASN . . . . . 0.475 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' SER . . . . . 0.71 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ILE . . . . . 0.512 HD11 ' HB3' ' B' ' 82' ' ' PHE . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' GLN . . . . . 0.466 ' O ' HG23 ' B' ' 103' ' ' VAL . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ILE . . . . . 0.42 HD11 HG21 ' B' ' 9' ' ' VAL . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 101' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 99' ' ' GLN . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' VAL . . . . . 0.633 ' HB ' HG12 ' B' ' 81' ' ' VAL . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' ASN . . . . . 0.59 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' B' ' 120' ' ' LEU . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' CYS . . . . . 0.779 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 120' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' B' ' 117' ' ' LYS . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.625 ' HG3' HD12 ' B' ' 84' ' ' ILE . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' ASP . . . . . 0.538 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLN . . . . . 0.538 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ILE . . . . . 0.417 ' CD1' ' H61' ' B' ' 210' ' ' PCW . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 145' ' ' SER . . . . . 0.59 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 146' ' ' ALA . . . . . 0.435 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 149' ' ' ARG . . . . . 0.767 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' ASP . . . . . 0.458 ' HA ' HD11 ' B' ' 23' ' ' LEU . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' ILE . . . . . 0.556 HG22 ' HE2' ' B' ' 167' ' ' LYS . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' LYS . . . . . 0.556 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 168' ' ' GLU . . . . . 0.666 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 169' ' ' LYS . . . . . 0.783 ' HG3' ' H82' ' B' ' 202' ' ' PCW . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 172' ' ' LYS . . . . . 0.666 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 55.3 mtmt -99.83 -39.47 8.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -78.15 -54.75 5.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.856 0.36 . . . . 10.0 111.299 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 127.99 -95.09 0.4 Allowed Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.736 -0.945 . . . . 10.0 110.736 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -168.98 48.7 0.04 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.209 0.528 . . . . 10.0 111.118 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' LYS . . . . . 0.42 ' HB3' ' HE2' ' B' ' 176' ' ' LYS . 28.4 mtpt -125.01 123.84 40.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.124 0.487 . . . . 10.0 111.808 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -80.53 125.25 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.496 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -147.71 -169.45 3.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.119 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 179' ' ' LYS . . . . . 0.692 ' HE2' ' H2 ' ' B' ' 202' ' ' PCW . 5.0 tmtm? 71.7 91.06 0.09 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.364 0.602 . . . . 10.0 111.377 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -141.76 23.89 2.07 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.628 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 94.9 6.17 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.872 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -146.74 90.06 1.88 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.046 0.451 . . . . 10.0 110.856 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 4.4 t -102.4 131.71 48.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.467 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 184' ' ' LYS . . . . . 0.412 ' HE2' H151 ' A' ' 402' ' ' PCW . 36.3 tttm -169.25 -38.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.603 -0.271 . . . . 10.0 111.198 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--O 1.239 0.51 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.812 179.899 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 358' ' ' ILE . . . . . 0.516 ' O ' HG13 ' D' ' 369' ' ' VAL . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 359' ' ' ARG . . . . . 0.659 ' HA ' HG22 ' D' ' 369' ' ' VAL . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 361' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' D' ' 425' ' ' GLU . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 369' ' ' VAL . . . . . 0.802 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 371' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' B' ' 36' ' ' ILE . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 373' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' D' ' 373' ' ' ARG . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 378' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 426' ' ' LEU . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 20.8 t60 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 384' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' D' ' 387' ' ' LYS . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 387' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' D' ' 384' ' ' LYS . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 388' ' ' VAL . . . . . 0.656 ' HB ' HG21 ' B' ' 21' ' ' ILE . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 389' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' D' ' 389' ' ' ARG . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 395' ' ' CYS . . . . . 0.464 ' O ' ' HA ' ' D' ' 430' ' ' PHE . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 399' ' ' PHE . . . . . 0.709 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 400' ' ' ARG . . . . . 0.465 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 410' ' ' ALA . . . . . 0.465 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 411' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' D' ' 411' ' ' ARG . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 416' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 425' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' D' ' 361' ' ' PHE . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 426' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 378' ' ' LEU . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 429' ' ' ASP . . . . . 0.709 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 430' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 437' ' ' THR . . . . . 0.525 ' HB ' HG21 ' D' ' 467' ' ' THR . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 440' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' D' ' 465' ' ' CYS . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 443' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' D' ' 443' ' ' ARG . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 446' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' D' ' 471' ' ' LYS . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 450' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 451' ' ' PHE . . . . . 0.562 ' CE1' ' H63' ' D' ' 501' ' ' PCW . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 460' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' D' ' 461' ' ' ASN . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 461' ' ' ASN . . . . . 0.432 HD22 ' C3 ' ' B' ' 213' ' ' 17F . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 465' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 467' ' ' THR . . . . . 0.525 HG21 ' HB ' ' D' ' 437' ' ' THR . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 471' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' D' ' 450' ' ' ALA . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' D' D ' 472' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 473' ' ' HIS . . . . . 0.5 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 476' ' ' CYS . . . . . 0.692 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 480' ' ' VAL . . . . . 0.418 HG12 ' O ' ' D' ' 476' ' ' CYS . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 401' ' ' PCW . . . . . 1.11 H182 H221 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 402' ' ' PCW . . . . . 0.9 H342 H212 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 403' ' ' PCW . . . . . 1.001 ' H82' H351 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 404' ' ' PCW . . . . . 0.975 ' H41' ' H32' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 405' ' ' PCW . . . . . 1.171 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 406' ' ' PCW . . . . . 0.783 H452 H471 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 407' ' ' PCW . . . . . 1.04 ' H82' ' H2 ' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 408' ' ' PCW . . . . . 1.079 H122 ' H71' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 409' ' ' 17F . . . . . 1.079 ' H71' H122 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' 17F . . . . . 0.908 ' H78' H482 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 411' ' ' PCW . . . . . 1.061 H161 H331 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' PCW . . . . . 0.98 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' PCW . . . . . 1.066 H422 ' C23' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 414' ' ' PCW . . . . . 0.871 H272 H482 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 415' ' ' PCW . . . . . 1.1 H372 ' C43' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' PCW . . . . . 1.01 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 417' ' ' PCW . . . . . 1.064 H141 H382 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 601' ' ' PCW . . . . . 1.013 H472 H432 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 602' ' ' PCW . . . . . 0.866 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 603' ' ' PCW . . . . . 1.067 H371 H412 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 604' ' ' PCW . . . . . 0.966 H482 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 605' ' ' PCW . . . . . 0.978 ' O31' ' H51' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 606' ' ' PCW . . . . . 1.114 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 607' ' ' PCW . . . . . 1.074 H431 ' C1Z' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 608' ' ' PCW . . . . . 0.948 H281 ' H52' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 609' ' ' PCW . . . . . 1.041 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 610' ' ' PCW . . . . . 0.966 H452 H481 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 611' ' ' PCW . . . . . 1.067 H232 H471 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 612' ' ' PCW . . . . . 1.03 H251 ' H47' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 613' ' ' PCW . . . . . 0.966 H421 ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 614' ' ' PCW . . . . . 0.911 H211 ' H41' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 615' ' ' PCW . . . . . 1.026 ' H31' ' O4P' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 616' ' ' PCW . . . . . 1.1 ' C43' H372 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 617' ' ' PCW . . . . . 0.942 H142 ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 618' ' ' PCW . . . . . 0.966 H481 H452 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 619' ' ' PCW . . . . . 1.081 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 620' ' ' PCW . . . . . 1.081 ' H52' ' O1P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 621' ' ' PCW . . . . . 1.055 H122 ' H67' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 622' ' ' PCW . . . . . 1.055 ' C36' H322 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 623' ' ' PCW . . . . . 1.036 H261 H421 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 624' ' ' PCW . . . . . 1.057 ' H19' ' H73' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 625' ' ' PCW . . . . . 1.0 H281 ' H51' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 626' ' ' 17F . . . . . 1.074 ' C1Z' H431 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 627' ' ' 17F . . . . . 1.055 ' H67' H122 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 628' ' ' 17F . . . . . 0.953 ' H4A' ' C8 ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 629' ' ' 17F . . . . . 0.833 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 630' ' ' 17F . . . . . 1.01 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 631' ' ' 17F . . . . . 1.041 ' H6A' ' H63' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 632' ' ' 17F . . . . . 1.05 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' PCW . . . . . 1.0 H121 H132 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' PCW . . . . . 1.083 ' C4 ' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' PCW . . . . . 1.058 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' PCW . . . . . 1.029 H131 H151 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' PCW . . . . . 1.12 H332 H121 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' PCW . . . . . 1.077 H332 H331 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 207' ' ' PCW . . . . . 1.292 H251 ' C20' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' PCW . . . . . 1.029 H151 H131 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 209' ' ' PCW . . . . . 1.056 H121 H351 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 210' ' ' PCW . . . . . 0.929 ' H11' H131 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 211' ' ' PCW . . . . . 1.073 H352 ' O31' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 212' ' ' PCW . . . . . 1.04 H422 ' H59' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 213' ' ' 17F . . . . . 1.043 H20A H142 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' 17F . . . . . 0.989 ' H32' H283 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 215' ' ' 17F . . . . . 1.076 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 216' ' ' GNP . . . . . 0.613 ' O1G' ' HB3' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 501' ' ' PCW . . . . . 1.022 H161 ' H18' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 502' ' ' PCW . . . . . 1.022 H231 H381 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 503' ' ' PCW . . . . . 1.079 H152 ' H39' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 504' ' ' PCW . . . . . 0.896 ' H31' H161 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 505' ' ' PCW . . . . . 1.077 H331 H332 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 506' ' ' PCW . . . . . 1.028 H272 H421 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 507' ' ' PCW . . . . . 1.079 ' H39' H152 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 508' ' ' PCW . . . . . 1.252 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 509' ' ' PCW . . . . . 1.057 ' H61' H321 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 510' ' ' PCW . . . . . 1.057 H321 ' H61' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 511' ' ' 17F . . . . . 1.032 H12A H471 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 512' ' ' 17F . . . . . 1.01 ' H31' ' H2 ' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 513' ' ' 17F . . . . . 1.074 ' H11' ' H65' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 514' ' ' 17F . . . . . 1.04 ' H59' H422 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 515' ' ' PCW . . . . . 1.031 H212 H271 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 516' ' ' PCW . . . . . 0.996 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 221' ' ' LEU . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . 0.467 ' O ' HG23 ' A' ' 224' ' ' VAL . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 218' ' ' ARG . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . 0.67 HG22 ' HD3' ' C' ' 550' ' ' LYS . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.621 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.621 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.41 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.652 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 250' ' ' VAL . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.805 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 254' ' ' VAL . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.805 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.464 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.467 ' HG ' HG22 ' A' ' 254' ' ' VAL . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.665 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 273' ' ' ARG . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.718 ' HG2' HD21 ' C' ' 499' ' ' LEU . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.458 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.575 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.464 ' HB3' HD12 ' A' ' 301' ' ' LEU . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.527 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' C' ' 473' ' ' LYS . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . 0.406 ' OE2' HD22 ' C' ' 469' ' ' LEU . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.431 ' HG3' HD11 ' C' ' 469' ' ' LEU . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.664 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.469 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.762 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.4 ' HD3' HH11 ' A' ' 330' ' ' ARG . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 338' ' ' LEU . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 363' ' ' LYS . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . 0.57 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . 0.721 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.982 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.982 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.67 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 364' ' ' ALA . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 376' ' ' LEU . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 384' ' ' VAL . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 380' ' ' GLU . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.92 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' SER . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.806 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . 0.42 ' HB3' ' HB2' ' C' ' 403' ' ' ASP . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' C' ' 400' ' ' LYS . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.416 ' O ' HG23 ' C' ' 408' ' ' VAL . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.416 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.645 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.459 ' HD1' HD12 ' C' ' 415' ' ' LEU . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' C' ' 411' ' ' THR . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.549 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.473 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.486 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' C' ' 435' ' ' GLU . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' C' ' 440' ' ' GLU . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.476 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' C' ' 437' ' ' LEU . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . 0.476 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.732 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.563 ' O ' HG12 ' C' ' 448' ' ' VAL . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.732 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.615 HG23 HG22 ' C' ' 448' ' ' VAL . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' C' ' 456' ' ' LEU . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.634 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.644 ' HA ' ' CG ' ' C' ' 475' ' ' GLU . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.534 ' HG2' HD13 ' A' ' 301' ' ' LEU . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.644 ' CG ' ' HA ' ' C' ' 471' ' ' ARG . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' C' ' 477' ' ' LEU . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' C' ' 475' ' ' GLU . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB3' ' NH1' ' C' ' 486' ' ' ARG . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . 0.417 ' NH1' ' HB3' ' C' ' 482' ' ' GLN . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' C' ' 496' ' ' LEU . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.437 ' HE3' HD22 ' A' ' 279' ' ' LEU . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' C' ' 492' ' ' LEU . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.78 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.78 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 275' ' ' LYS . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.505 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' C' ' 508' ' ' ARG . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' C' ' 505' ' ' ASP . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.665 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.558 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.524 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . 0.431 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.677 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.652 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.458 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . 0.515 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.67 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 570' ' ' ARG . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HA ' HG12 ' C' ' 576' ' ' VAL . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.493 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' C' ' 577' ' ' LEU . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.511 ' O ' HG23 ' C' ' 582' ' ' VAL . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 578' ' ' GLU . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.806 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.92 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' HB ' ' B' ' 50' ' ' THR . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' B' ' 52' ' ' LEU . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.649 HD11 HD22 ' B' ' 53' ' ' LEU . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.654 HG12 ' HB2' ' B' ' 79' ' ' LEU . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . 0.479 ' HA2' ' HE1' ' B' ' 32' ' ' TYR . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.412 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.497 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.494 HD13 HG12 ' B' ' 152' ' ' VAL . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' B' ' 42' ' ' LYS . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.484 ' CD ' ' H ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.479 ' HE1' ' HA2' ' B' ' 13' ' ' GLY . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.761 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HB2' HD12 ' B' ' 24' ' ' ILE . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.528 ' HB2' HH12 ' B' ' 164' ' ' ARG . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 3' ' ' GLU . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.649 HD22 HD11 ' B' ' 6' ' ' LEU . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.431 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . 0.414 ' HE1' ' NH2' ' B' ' 102' ' ' ARG . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.616 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.646 ' HA3' HD21 ' B' ' 159' ' ' LEU . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.849 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' B' ' 8' ' ' VAL . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.412 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.79 HD11 ' HA ' ' B' ' 118' ' ' CYS . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.53 HD21 ' HB3' ' B' ' 88' ' ' LYS . 47.3 t30 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.53 ' HB3' HD21 ' B' ' 86' ' ' ASN . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 93' ' ' ILE . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.45 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . 0.414 ' NH2' ' HE1' ' B' ' 64' ' ' TYR . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.45 HG23 ' O ' ' B' ' 99' ' ' GLN . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.849 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.678 HG13 ' HG2' ' B' ' 140' ' ' PRO . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' B' ' 141' ' ' PHE . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.613 HG22 ' HB ' ' B' ' 142' ' ' ILE . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.484 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.79 ' HA ' HD11 ' B' ' 84' ' ' ILE . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.484 HD12 ' HB3' ' B' ' 117' ' ' LYS . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.699 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.533 ' HG3' HD12 ' B' ' 84' ' ' ILE . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.458 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.479 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.678 ' HG2' HG13 ' B' ' 112' ' ' VAL . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' B' ' 113' ' ' LEU . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' B' ' 114' ' ' VAL . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.527 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . 0.494 HG12 HD13 ' B' ' 23' ' ' LEU . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.647 HD23 HD22 ' B' ' 6' ' ' LEU . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.528 HH12 ' HB2' ' B' ' 47' ' ' ASP . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . 0.467 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' B' ' 172' ' ' LYS . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 165' ' ' LYS . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 168' ' ' GLU . 52.5 mtmt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' D' ' 368' ' ' THR . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' D' ' 427' ' ' GLN . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.623 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.623 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' D' ' 436' ' ' LEU . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.535 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.761 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' D' ' 381' ' ' CYS . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . 0.475 ' HG3' ' H ' ' D' ' 374' ' ' ASN . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . 0.475 ' H ' ' HG3' ' D' ' 373' ' ' ARG . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.501 HD22 HD22 ' D' ' 426' ' ' LEU . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' D' ' 382' ' ' LEU . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.858 HD21 HG21 ' D' ' 428' ' ' VAL . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' D' ' 393' ' ' PRO . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . 0.468 ' HD3' HD21 ' D' ' 386' ' ' LEU . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . 0.685 ' HA ' ' HB3' ' D' ' 432' ' ' ASP . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . 0.503 ' HB3' HG12 ' D' ' 428' ' ' VAL . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.434 ' HB3' ' HB3' ' D' ' 409' ' ' LYS . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' D' ' 426' ' ' LEU . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . 0.48 HD13 ' HB2' ' D' ' 425' ' ' GLU . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.44 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.434 ' HB3' ' HB3' ' D' ' 399' ' ' PHE . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . 0.491 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.463 ' HA ' HD23 ' D' ' 412' ' ' LEU . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.463 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.48 ' HB2' HD13 ' D' ' 401' ' ' LEU . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.523 HD12 ' HA ' ' D' ' 400' ' ' ARG . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' D' ' 361' ' ' PHE . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.858 HG21 HD21 ' D' ' 382' ' ' LEU . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . 0.685 ' HB3' ' HA ' ' D' ' 395' ' ' CYS . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . 0.527 ' HA ' ' HB2' ' D' ' 364' ' ' ASN . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' D' ' 459' ' ' LEU . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . 0.455 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . 0.489 ' O ' ' HD2' ' D' ' 457' ' ' LYS . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' D' ' 456' ' ' GLN . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.64 ' HB2' ' HB2' ' D' ' 452' ' ' CYS . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.423 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.423 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' D' ' 470' ' ' TYR . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . 0.415 ' HB3' ' SG ' ' D' ' 465' ' ' CYS . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.963 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.963 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . 0.582 ' HG3' ' H ' ' D' ' 484' ' ' CYS . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.582 ' H ' ' HG3' ' D' ' 483' ' ' MET . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . 0.537 HD21 HD21 ' C' ' 569' ' ' LEU . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . 0.528 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 213' ' ' THR . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . 0.585 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.585 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.641 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.551 ' O ' ' HG3' ' A' ' 240' ' ' ARG . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.518 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 236' ' ' THR . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.631 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 250' ' ' VAL . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.71 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.447 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . 0.474 ' HA ' ' NE2' ' A' ' 255' ' ' GLN . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.534 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 30.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.489 ' HG ' HG22 ' A' ' 254' ' ' VAL . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.458 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.563 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 268' ' ' GLU . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 265' ' ' TRP . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.419 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.41 ' O ' HG12 ' A' ' 276' ' ' VAL . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.741 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.589 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . 0.406 ' HG2' ' OE2' ' A' ' 293' ' ' GLU . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 289' ' ' GLN . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.596 ' HG3' HD21 ' C' ' 477' ' ' LEU . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.509 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.567 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.567 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.599 ' HB3' ' HE3' ' C' ' 473' ' ' LYS . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.509 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.51 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.682 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.592 ' HG3' HD21 ' C' ' 469' ' ' LEU . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.682 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' A' ' 320' ' ' LEU . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.522 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.69 HD23 ' HD2' ' A' ' 330' ' ' ARG . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.751 HH21 ' HB3' ' C' ' 447' ' ' GLU . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.437 ' HG2' ' OE1' ' C' ' 440' ' ' GLU . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.511 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.761 HD21 ' HB3' ' C' ' 432' ' ' LYS . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.511 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.5 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.783 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.792 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.792 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.783 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.663 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 397' ' ' LEU . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.718 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 393' ' ' TYR . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.438 ' O ' HG23 ' C' ' 408' ' ' VAL . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . 0.461 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.438 HG23 ' O ' ' C' ' 404' ' ' ASN . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.415 HG23 ' HE2' ' A' ' 363' ' ' LYS . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.42 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' C' ' 413' ' ' SER . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . 0.578 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.509 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.761 ' HB3' HD21 ' A' ' 341' ' ' ASN . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 345' ' ' ARG . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.437 ' OE1' ' HG2' ' A' ' 334' ' ' ARG . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.733 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.441 ' O ' HG12 ' C' ' 448' ' ' VAL . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.751 ' HB3' HH21 ' A' ' 330' ' ' ARG . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.733 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' C' ' 456' ' ' LEU . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.51 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' C' ' 452' ' ' VAL . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' C' ' 471' ' ' ARG . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.592 HD21 ' HG3' ' A' ' 308' ' ' ARG . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' C' ' 468' ' ' GLU . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.599 ' HE3' ' HB3' ' A' ' 301' ' ' LEU . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.596 HD21 ' HG3' ' A' ' 297' ' ' LYS . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.741 ' HE3' HD22 ' A' ' 279' ' ' LEU . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.558 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.885 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.437 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.654 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.563 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.444 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.586 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.67 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.646 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.458 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.631 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.565 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.721 HD23 HD12 ' C' ' 536' ' ' LEU . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.721 HD12 HD23 ' C' ' 533' ' ' LEU . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 543' ' ' ARG . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . 0.596 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' C' ' 558' ' ' LEU . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.537 HD21 HD21 ' A' ' 206' ' ' ASN . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.573 ' HA ' HG12 ' C' ' 576' ' ' VAL . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.573 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.538 ' O ' HG23 ' C' ' 582' ' ' VAL . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.538 HG23 ' O ' ' C' ' 578' ' ' GLU . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . 0.525 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.718 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' C' ' 584' ' ' PHE . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.663 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.583 ' HB2' ' HG3' ' B' ' 76' ' ' GLU . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.644 HD22 HD23 ' B' ' 159' ' ' LEU . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' B' ' 80' ' ' CYS . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.425 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.656 HD13 HG11 ' D' ' 388' ' ' VAL . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.469 HD22 HG12 ' B' ' 152' ' ' VAL . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.582 HD13 ' HD3' ' B' ' 42' ' ' LYS . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.661 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.706 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.448 ' HB3' HG13 ' B' ' 24' ' ' ILE . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.582 ' HD3' HD13 ' B' ' 24' ' ' ILE . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' D' ' 467' ' ' THR . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' B' ' 46' ' ' ILE . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' D' ' 464' ' ' ARG . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.502 HG13 ' HB ' ' B' ' 44' ' ' VAL . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' D' ' 448' ' ' LYS . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.547 ' HA ' ' HE3' ' D' ' 471' ' ' LYS . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.475 HD22 HD11 ' B' ' 6' ' ' LEU . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.661 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.434 ' HE3' HG21 ' B' ' 103' ' ' VAL . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . 0.583 ' HG3' ' HB2' ' B' ' 5' ' ' LYS . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.52 ' O ' ' HA ' ' B' ' 111' ' ' MET . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.947 ' HG ' HD22 ' B' ' 159' ' ' LEU . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.523 ' HB2' HD12 ' B' ' 93' ' ' ILE . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.696 HG12 ' HB ' ' B' ' 114' ' ' VAL . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.558 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.925 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.558 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.48 ' ND2' ' HB3' ' B' ' 88' ' ' LYS . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.48 ' HB3' ' ND2' ' B' ' 86' ' ' ASN . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.504 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' B' ' 82' ' ' PHE . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 97' ' ' ARG . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.435 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 99' ' ' GLN . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . 0.473 ' HB2' HG13 ' B' ' 109' ' ' VAL . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . 0.473 HG13 ' HB2' ' B' ' 106' ' ' SER . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' B' ' 109' ' ' VAL . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.618 ' HB ' HD23 ' B' ' 79' ' ' LEU . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.696 ' HB ' HG12 ' B' ' 81' ' ' VAL . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' B' ' 144' ' ' THR . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.925 ' HA ' HD11 ' B' ' 84' ' ' ILE . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.871 ' HG3' HD12 ' B' ' 84' ' ' ILE . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.613 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.529 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.613 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' B' ' 127' ' ' THR . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . 0.444 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.444 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.459 ' HG2' HG13 ' B' ' 112' ' ' VAL . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 23' ' ' LEU . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . 0.466 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.466 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.568 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.947 HD22 ' HG ' ' B' ' 79' ' ' LEU . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.536 ' HG3' HG22 ' D' ' 369' ' ' VAL . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.748 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.748 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . 0.458 ' HB3' ' H ' ' D' ' 365' ' ' LYS . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' D' ' 364' ' ' ASN . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.706 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.428 HD12 ' O ' ' D' ' 413' ' ' ASP . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.656 HD21 HG21 ' D' ' 428' ' ' VAL . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.656 HG11 HD13 ' B' ' 21' ' ' ILE . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.639 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.639 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' D' ' 413' ' ' ASP . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . 0.47 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' D' ' 359' ' ' ARG . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.656 HG21 HD21 ' D' ' 382' ' ' LEU . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' D' ' 433' ' ' HIS . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.533 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . 0.412 ' HB3' ' HB3' ' D' ' 430' ' ' PHE . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' D' ' 436' ' ' LEU . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . 0.468 ' HA ' HD13 ' D' ' 436' ' ' LEU . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.414 ' CE1' ' SG ' ' D' ' 465' ' ' CYS . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . 0.698 ' HB2' ' HD3' ' D' ' 464' ' ' ARG . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . 0.426 HD12 ' H ' ' B' ' 47' ' ' ASP . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 47' ' ' ASP . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . 0.497 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.785 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.45 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.698 ' HD3' ' HB2' ' D' ' 444' ' ' LYS . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.662 ' HB2' ' H ' ' D' ' 470' ' ' TYR . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' B' ' 43' ' ' GLN . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . 0.562 ' N ' ' HB2' ' D' ' 465' ' ' CYS . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . 0.662 ' H ' ' HB2' ' D' ' 465' ' ' CYS . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.785 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.814 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . 0.54 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.417 ' HA ' HD12 ' A' ' 204' ' ' LEU . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 201' ' ' LEU . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . 0.468 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 226' ' ' GLN . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 222' ' ' GLY . 19.4 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.642 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.869 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.869 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 239' ' ' LEU . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.559 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 235' ' ' GLU . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.559 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.749 ' HG3' HD12 ' A' ' 247' ' ' LEU . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.593 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.569 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.749 HD12 ' HG3' ' A' ' 243' ' ' MET . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.593 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.575 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.575 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.533 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.533 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.456 ' HA ' ' CE1' ' C' ' 517' ' ' HIS . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.408 ' HG ' HG22 ' A' ' 254' ' ' VAL . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.603 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.464 ' O ' ' HB2' ' A' ' 269' ' ' MET . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 265' ' ' TRP . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 274' ' ' GLN . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 270' ' ' GLU . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.707 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.435 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.471 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . 0.403 ' O ' ' HG3' ' A' ' 290' ' ' LYS . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 286' ' ' GLY . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.484 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.42 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.771 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.771 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' C' ' 473' ' ' LYS . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.592 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.619 ' HG3' HD11 ' C' ' 469' ' ' LEU . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.592 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.582 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.67 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.67 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.595 HH21 ' HB3' ' C' ' 447' ' ' GLU . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.55 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.55 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.502 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . 0.461 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.884 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.884 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 364' ' ' ALA . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 368' ' ' LEU . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . 0.418 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 375' ' ' LEU . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 384' ' ' VAL . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 380' ' ' GLU . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.461 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.615 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.491 ' O ' HG23 ' C' ' 408' ' ' VAL . 7.9 t-20 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.491 HG23 ' O ' ' C' ' 404' ' ' ASN . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.568 ' HD1' HD12 ' C' ' 415' ' ' LEU . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.568 HD12 ' HD1' ' C' ' 412' ' ' PHE . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.419 ' HA ' HD12 ' C' ' 430' ' ' LEU . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.502 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' C' ' 427' ' ' TRP . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' C' ' 440' ' ' GLU . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 436' ' ' GLY . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.578 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.595 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.619 HD11 ' HG3' ' A' ' 308' ' ' ARG . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.666 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.62 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' C' ' 487' ' ' GLN . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' C' ' 483' ' ' GLU . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.668 ' HE3' HD22 ' A' ' 279' ' ' LEU . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.519 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.883 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.883 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.621 HD21 ' HG2' ' A' ' 275' ' ' LYS . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.519 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.534 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.58 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.58 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.603 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.569 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' C' ' 515' ' ' ARG . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' C' ' 519' ' ' ALA . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.456 ' CE1' ' HA ' ' A' ' 257' ' ' TYR . 40.8 m170 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.69 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' C' ' 526' ' ' ARG . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' C' ' 522' ' ' SER . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.569 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.601 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.677 ' HB3' ' HE3' ' C' ' 563' ' ' LYS . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.677 ' HE3' ' HB3' ' C' ' 559' ' ' SER . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.531 ' HA ' HG12 ' C' ' 576' ' ' VAL . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' C' ' 581' ' ' LYS . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' C' ' 578' ' ' GLU . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.615 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.591 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.885 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 152' ' ' VAL . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.832 HG23 ' HD3' ' B' ' 42' ' ' LYS . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . 0.486 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.804 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.871 ' HB3' HG23 ' D' ' 369' ' ' VAL . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.799 ' HE1' ' HB2' ' B' ' 57' ' ' ASP . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.832 ' HD3' HG23 ' B' ' 24' ' ' ILE . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' HA ' ' D' ' 468' ' ' CYS . 1.5 mp0 -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . 0.489 HG12 ' NH2' ' D' ' 464' ' ' ARG . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' HD12 ' D' ' 447' ' ' LEU . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.695 ' HA ' ' HD3' ' D' ' 448' ' ' LYS . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . 0.729 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' B' ' 40' ' ' TYR . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB2' ' HE1' ' B' ' 40' ' ' TYR . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.804 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.442 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 73' ' ' ARG . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.813 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' B' ' 112' ' ' VAL . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 113' ' ' LEU . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' B' ' 114' ' ' VAL . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.404 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.765 HD11 ' HA ' ' B' ' 118' ' ' CYS . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' B' ' 82' ' ' PHE . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . 0.453 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.518 ' O ' HG23 ' B' ' 103' ' ' VAL . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 99' ' ' GLN . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.813 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.693 ' HB ' HD23 ' B' ' 79' ' ' LEU . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' B' ' 80' ' ' CYS . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.54 ' HB ' HG12 ' B' ' 81' ' ' VAL . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.765 ' HA ' HD11 ' B' ' 84' ' ' ILE . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.485 ' NH2' ' HB2' ' B' ' 118' ' ' CYS . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.512 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' B' ' 133' ' ' LEU . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . 0.741 HG21 ' HB2' ' B' ' 155' ' ' ALA . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.643 ' HB ' HG22 ' B' ' 152' ' ' VAL . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.885 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . 0.643 HG22 ' HB ' ' B' ' 144' ' ' THR . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . 0.741 ' HB2' HG21 ' B' ' 142' ' ' ILE . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.591 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.678 HD22 ' HG ' ' B' ' 79' ' ' LEU . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.591 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.432 HG13 ' O ' ' B' ' 159' ' ' LEU . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' B' ' 164' ' ' ARG . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' B' ' 165' ' ' LYS . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.439 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' D' ' 426' ' ' LEU . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.511 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.511 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . 0.543 ' HD2' ' OE1' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.871 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.447 ' HB2' HD11 ' B' ' 36' ' ' ILE . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' D' ' 417' ' ' ASP . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' D' ' 416' ' ' THR . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.819 HD21 HG21 ' D' ' 428' ' ' VAL . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.591 ' CG1' HD13 ' B' ' 21' ' ' ILE . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.434 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . 0.58 HD13 ' HB2' ' D' ' 425' ' ' GLU . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' D' ' 403' ' ' GLN . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . 0.434 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.435 HD13 HG21 ' D' ' 416' ' ' THR . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.494 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . 0.663 ' HA ' ' HA ' ' D' ' 377' ' ' SER . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.58 ' HB2' HD13 ' D' ' 401' ' ' LEU . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.819 HG21 HD21 ' D' ' 382' ' ' LEU . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.466 ' HB2' ' H ' ' D' ' 432' ' ' ASP . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 467' ' ' THR . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.463 ' HA ' ' SG ' ' D' ' 468' ' ' CYS . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . 0.435 ' HB3' ' CE1' ' D' ' 463' ' ' PHE . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . 0.488 HD12 ' O ' ' B' ' 45' ' ' VAL . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . 0.695 ' HD3' ' HA ' ' B' ' 47' ' ' ASP . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . 0.599 ' H ' ' HG2' ' D' ' 448' ' ' LYS . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . 0.729 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.657 ' HA ' HD23 ' D' ' 459' ' ' LEU . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . 0.556 ' HG2' ' H ' ' D' ' 458' ' ' PHE . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . 0.556 ' H ' ' HG2' ' D' ' 457' ' ' LYS . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.657 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.48 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' D' ' 443' ' ' ARG . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.489 ' NH2' HG12 ' B' ' 44' ' ' VAL . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.443 ' CB ' ' SG ' ' D' ' 468' ' ' CYS . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 437' ' ' THR . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.651 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.993 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.993 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.572 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 204' ' ' LEU . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.414 HD12 HD23 ' A' ' 201' ' ' LEU . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.498 ' HE3' ' HA ' ' A' ' 229' ' ' TRP . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.769 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.769 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.49 ' HB ' ' CZ ' ' A' ' 240' ' ' ARG . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 236' ' ' THR . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.643 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.653 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' HG12 ' A' ' 250' ' ' VAL . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.539 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.458 ' O ' HG12 ' A' ' 254' ' ' VAL . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.585 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.585 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.411 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.57 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.52 ' NZ ' ' HB2' ' C' ' 513' ' ' ALA . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.484 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.413 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.763 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 272' ' ' TYR . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.452 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . 0.542 ' HA ' ' HB2' ' A' ' 298' ' ' LEU . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 295' ' ' GLN . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.797 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.797 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.609 ' HG3' HD21 ' C' ' 469' ' ' LEU . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.561 ' HA ' HD12 ' A' ' 316' ' ' LEU . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 313' ' ' VAL . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.513 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.453 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.477 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.513 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.535 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.653 HD23 ' HD2' ' A' ' 330' ' ' ARG . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 324' ' ' SER . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.653 ' HD2' HD23 ' A' ' 327' ' ' LEU . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.661 ' HD3' ' OE1' ' C' ' 440' ' ' GLU . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.436 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.446 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . 0.417 ' HB3' ' HE2' ' A' ' 365' ' ' LYS . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.713 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.846 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.846 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.713 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.401 ' O ' HG23 ' A' ' 384' ' ' VAL . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 380' ' ' GLU . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.573 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.504 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 395' ' ' LYS . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.751 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.577 ' O ' HG23 ' C' ' 408' ' ' VAL . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.577 HG23 ' O ' ' C' ' 404' ' ' ASN . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.442 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' C' ' 413' ' ' SER . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.661 ' OE1' ' HD3' ' A' ' 334' ' ' ARG . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.468 ' HD2' ' CZ2' ' C' ' 463' ' ' TRP . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.468 ' CZ2' ' HD2' ' C' ' 459' ' ' PHE . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.62 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.609 HD21 ' HG3' ' A' ' 308' ' ' ARG . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.484 ' HE2' HD22 ' C' ' 469' ' ' LEU . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.438 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.582 ' HE3' HD22 ' A' ' 279' ' ' LEU . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.504 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.565 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 279' ' ' LEU . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.623 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.623 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.529 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.668 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.614 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.614 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.664 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.576 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.653 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.437 HD23 HD12 ' C' ' 536' ' ' LEU . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.403 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.437 HD12 HD23 ' C' ' 533' ' ' LEU . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.424 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.545 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.458 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.751 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' C' ' 592' ' ' THR . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' B' ' 50' ' ' THR . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.432 ' HG3' HD23 ' B' ' 52' ' ' LEU . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.748 HG12 ' HB2' ' B' ' 79' ' ' LEU . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.493 HG21 HD11 ' B' ' 100' ' ' ILE . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.598 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.488 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.536 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.464 HG23 ' HD3' ' B' ' 42' ' ' LYS . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.495 HE21 ' HE2' ' B' ' 40' ' ' TYR . 71.7 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.449 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.679 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.749 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.495 ' HE2' HE21 ' B' ' 25' ' ' GLN . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HD3' HG23 ' B' ' 24' ' ' ILE . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.621 ' O ' ' HA3' ' D' ' 469' ' ' GLY . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . 0.539 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' B' ' 1' ' ' MET . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' B' ' 3' ' ' GLU . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.679 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.458 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . 0.425 ' HE1' ' HB2' ' B' ' 69' ' ' ASP . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.535 ' HA ' ' CE1' ' B' ' 71' ' ' TYR . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.425 ' HB2' ' HE1' ' B' ' 64' ' ' TYR . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' B' ' 73' ' ' ARG . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.487 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.748 ' HB2' HG12 ' B' ' 8' ' ' VAL . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.626 HG12 ' HB ' ' B' ' 114' ' ' VAL . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.505 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.544 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.474 HD21 ' HB3' ' B' ' 88' ' ' LYS . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' B' ' 86' ' ' ASN . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.587 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 89' ' ' SER . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' B' ' 93' ' ' ILE . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 103' ' ' VAL . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.493 HD11 HG21 ' B' ' 9' ' ' VAL . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 99' ' ' GLN . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.453 ' HD3' ' HZ ' ' B' ' 78' ' ' PHE . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.487 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.478 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 93' ' ' ILE . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.626 ' HB ' HG12 ' B' ' 81' ' ' VAL . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.691 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.405 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.405 HD12 ' HB3' ' B' ' 117' ' ' LYS . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.505 ' HG3' HD13 ' B' ' 84' ' ' ILE . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.799 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.421 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.799 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 127' ' ' THR . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.512 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.471 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . 0.691 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.536 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . 0.407 HG22 ' CG2' ' B' ' 144' ' ' THR . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . 0.435 ' O ' HG23 ' B' ' 160' ' ' VAL . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . 0.567 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.562 HD22 ' HG ' ' B' ' 79' ' ' LEU . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 156' ' ' PHE . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.538 HG22 ' HE2' ' B' ' 167' ' ' LYS . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' B' ' 164' ' ' ARG . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.538 ' HE2' HG22 ' B' ' 163' ' ' ILE . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . 0.504 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . 0.504 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 56.5 mtmt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' D' ' 369' ' ' VAL . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.715 ' HG2' HG22 ' D' ' 369' ' ' VAL . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.966 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.825 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 365' ' ' LYS . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.966 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.749 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.518 ' HB2' HD11 ' B' ' 36' ' ' ILE . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 426' ' ' LEU . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.501 HD21 HG21 ' D' ' 428' ' ' VAL . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . 0.477 HD21 ' HD3' ' D' ' 393' ' ' PRO . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.488 ' CG1' HD13 ' B' ' 21' ' ' ILE . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . 0.477 ' HD3' HD21 ' D' ' 386' ' ' LEU . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . 0.521 ' HA ' HD11 ' D' ' 431' ' ' LEU . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.422 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.492 ' HD2' HD21 ' D' ' 412' ' ' LEU . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' D' ' 409' ' ' LYS . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . 0.412 ' HE2' ' HB3' ' D' ' 406' ' ' LYS . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.619 ' HA ' HD21 ' D' ' 402' ' ' LEU . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.492 HD21 ' HD2' ' D' ' 400' ' ' ARG . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 378' ' ' LEU . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.501 HG21 HD21 ' D' ' 382' ' ' LEU . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' D' ' 395' ' ' CYS . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 467' ' ' THR . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . 0.516 ' HD1' ' HA ' ' D' ' 461' ' ' ASN . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . 0.539 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' D' ' 459' ' ' LEU . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.516 ' HA ' ' HD1' ' D' ' 446' ' ' PHE . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . 0.43 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.563 ' HB2' ' H ' ' D' ' 469' ' ' GLY . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 437' ' ' THR . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' B' ' 43' ' ' GLN . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . 0.43 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.425 HG22 ' H ' ' D' ' 482' ' ' THR . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . 0.425 ' H ' HG22 ' D' ' 480' ' ' VAL . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . 0.683 HG12 ' HZ3' ' D' ' 487' ' ' TRP . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . 0.683 ' HZ3' HG12 ' D' ' 485' ' ' VAL . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.562 ' HA ' HD12 ' A' ' 204' ' ' LEU . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 201' ' ' LEU . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' C' ' 550' ' ' LYS . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 232' ' ' LEU . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 228' ' ' PHE . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 241' ' ' GLN . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 237' ' ' GLU . 68.5 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.607 ' HA ' ' CZ ' ' C' ' 528' ' ' ARG . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 250' ' ' VAL . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.724 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.426 ' O ' HG12 ' A' ' 254' ' ' VAL . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.51 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.592 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.575 ' HA ' HG12 ' A' ' 276' ' ' VAL . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 274' ' ' GLN . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' C' ' 499' ' ' LEU . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.761 HD22 ' HE3' ' C' ' 495' ' ' LYS . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 279' ' ' LEU . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 291' ' ' LEU . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.502 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 298' ' ' LEU . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.558 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.648 HD22 ' HG2' ' C' ' 473' ' ' LYS . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.445 ' HG3' HD21 ' C' ' 469' ' ' LEU . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.725 ' HA ' HD12 ' A' ' 316' ' ' LEU . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 317' ' ' ARG . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.575 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.47 ' HA ' HD12 ' A' ' 331' ' ' LEU . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.55 HH21 ' HB3' ' C' ' 447' ' ' GLU . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 328' ' ' ARG . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.442 ' O ' ' HG ' ' A' ' 338' ' ' LEU . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.631 HD21 ' HB3' ' C' ' 432' ' ' LYS . 13.6 t-20 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.448 ' HA2' ' HE ' ' A' ' 345' ' ' ARG . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 348' ' ' GLU . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' C' ' 433' ' ' GLU . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.529 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.769 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 368' ' ' LEU . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.906 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.906 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 371' ' ' LEU . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.513 HD12 HD23 ' A' ' 368' ' ' LEU . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.447 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.454 ' O ' HG23 ' A' ' 384' ' ' VAL . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 380' ' ' GLU . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.531 ' HB2' ' CE ' ' C' ' 594' ' ' LYS . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . 0.451 ' HE2' ' HB2' ' C' ' 400' ' ' LYS . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' C' ' 415' ' ' LEU . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' C' ' 412' ' ' PHE . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.491 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.529 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.631 ' HB3' HD21 ' A' ' 341' ' ' ASN . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.449 ' HG2' ' HD3' ' A' ' 345' ' ' ARG . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.55 ' HB3' HH21 ' A' ' 330' ' ' ARG . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' C' ' 456' ' ' LEU . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . 0.454 ' HD1' ' HA ' ' C' ' 459' ' ' PHE . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.648 ' HG2' HD22 ' A' ' 301' ' ' LEU . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.433 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.761 ' HE3' HD22 ' A' ' 279' ' ' LEU . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.494 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.509 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.73 HD21 ' HG2' ' A' ' 275' ' ' LYS . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.747 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.609 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.777 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.777 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 34.1 m170 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.605 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.605 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.48 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.607 ' CZ ' ' HA ' ' A' ' 246' ' ' ASP . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.467 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.459 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.413 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' C' ' 560' ' ' GLU . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' C' ' 557' ' ' THR . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' C' ' 567' ' ' GLU . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' C' ' 563' ' ' LYS . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 563' ' ' LYS . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . 0.44 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.528 ' HA ' HG12 ' C' ' 576' ' ' VAL . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 570' ' ' ARG . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.531 ' CE ' ' HB2' ' A' ' 388' ' ' SER . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.644 ' HB2' HG22 ' B' ' 55' ' ' ILE . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' B' ' 78' ' ' PHE . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' B' ' 79' ' ' LEU . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 80' ' ' CYS . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.533 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.432 HG23 HD12 ' B' ' 55' ' ' ILE . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.684 HD13 ' CG1' ' D' ' 388' ' ' VAL . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.524 HG21 ' HD2' ' B' ' 40' ' ' TYR . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.658 ' HG2' ' HE2' ' B' ' 40' ' ' TYR . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.466 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' D' ' 371' ' ' ASN . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.694 ' HB3' HG23 ' D' ' 369' ' ' VAL . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' D' ' 366' ' ' GLN . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.658 ' HE2' ' HG2' ' B' ' 25' ' ' GLN . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.469 ' HB2' HH22 ' B' ' 164' ' ' ARG . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.534 HD22 HD11 ' B' ' 6' ' ' LEU . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.644 HG22 ' HB2' ' B' ' 6' ' ' LEU . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.696 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . 0.445 ' HA ' ' HE2' ' B' ' 72' ' ' MET . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.696 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' B' ' 69' ' ' ASP . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.437 ' HB2' HG12 ' B' ' 103' ' ' VAL . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.798 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.744 ' HB2' HG12 ' B' ' 8' ' ' VAL . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.45 ' HA ' HG23 ' B' ' 9' ' ' VAL . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.514 HG12 ' HB ' ' B' ' 114' ' ' VAL . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.765 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.533 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.516 HD11 ' HA ' ' B' ' 118' ' ' CYS . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.765 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . 0.412 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 89' ' ' SER . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.423 ' O ' HG23 ' B' ' 103' ' ' VAL . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.437 HG12 ' HB2' ' B' ' 73' ' ' ARG . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.798 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.448 HG13 ' HG2' ' B' ' 140' ' ' PRO . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.645 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.514 ' HB ' HG12 ' B' ' 81' ' ' VAL . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.516 ' HA ' HD11 ' B' ' 84' ' ' ILE . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.436 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.478 ' HA ' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.522 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.514 HG23 ' HE2' ' B' ' 141' ' ' PHE . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.522 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' B' ' 135' ' ' ARG . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.448 ' HG2' HG13 ' B' ' 112' ' ' VAL . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.514 ' HE2' HG23 ' B' ' 127' ' ' THR . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 149' ' ' ARG . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . 0.54 ' HE1' HG21 ' B' ' 55' ' ' ILE . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.722 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' B' ' 161' ' ' ARG . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.483 HG22 ' HE2' ' B' ' 167' ' ' LYS . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.469 HH22 ' HB2' ' B' ' 49' ' ' GLU . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.483 ' HE2' HG22 ' B' ' 163' ' ' ILE . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.433 ' HG2' HG22 ' D' ' 369' ' ' VAL . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.719 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.897 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . 0.42 ' HG3' ' OG ' ' B' ' 39' ' ' SER . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.694 HG23 ' HB3' ' B' ' 37' ' ' GLU . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.835 ' HB2' HD11 ' B' ' 36' ' ' ILE . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . 0.443 HG11 ' SG ' ' D' ' 381' ' ' CYS . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' D' ' 382' ' ' LEU . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . 0.443 ' SG ' HG11 ' D' ' 372' ' ' VAL . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' D' ' 378' ' ' LEU . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.684 ' CG1' HD13 ' B' ' 21' ' ' ILE . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . 0.432 ' HB3' HG12 ' D' ' 428' ' ' VAL . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.519 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.519 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . 0.43 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.483 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.432 HG12 ' HB3' ' D' ' 396' ' ' CYS . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.704 ' HA ' HD23 ' D' ' 459' ' ' LEU . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' D' ' 476' ' ' CYS . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.781 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.451 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.451 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' D' ' 470' ' ' TYR . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.457 ' CB ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . 0.502 ' O ' ' HA ' ' D' ' 464' ' ' ARG . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.781 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.898 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.898 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.47 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.457 ' HB3' ' CB ' ' D' ' 468' ' ' CYS . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . 0.56 HD22 HD12 ' A' ' 204' ' ' LEU . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . 0.56 HD12 HD22 ' A' ' 201' ' ' LEU . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 202' ' ' LYS . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . 0.468 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' A' ' 232' ' ' LEU . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.858 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 243' ' ' MET . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.732 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.461 ' C ' ' HB2' ' A' ' 248' ' ' GLU . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.546 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.732 HD12 ' HG3' ' A' ' 243' ' ' MET . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.461 ' HB2' ' C ' ' A' ' 244' ' ' SER . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.773 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.526 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.773 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.418 ' HG ' HG22 ' A' ' 254' ' ' VAL . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.408 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.559 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 270' ' ' GLU . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 266' ' ' GLN . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.624 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.455 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.525 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.665 HD13 ' HG2' ' C' ' 473' ' ' LYS . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.619 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.514 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 324' ' ' SER . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 330' ' ' ARG . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.553 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.417 ' HG2' ' OD1' ' C' ' 429' ' ' ASN . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 349' ' ' TYR . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 368' ' ' LEU . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 378' ' ' VAL . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 374' ' ' GLY . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.435 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 388' ' ' SER . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.528 ' O ' HG23 ' C' ' 408' ' ' VAL . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.528 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . 0.563 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.417 ' OD1' ' HG2' ' A' ' 345' ' ' ARG . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . 0.47 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.488 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.672 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.87 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.665 ' HG2' HD13 ' A' ' 301' ' ' LEU . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' C' ' 477' ' ' LEU . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.431 ' HE3' HD22 ' A' ' 279' ' ' LEU . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.423 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.836 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.836 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.47 HD21 ' HG2' ' A' ' 275' ' ' LYS . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.423 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.673 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.673 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.581 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.559 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.48 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.413 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.473 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.665 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.473 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.665 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . 0.428 ' HG ' HD22 ' C' ' 514' ' ' LEU . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.65 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.578 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' C' ' 528' ' ' ARG . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.578 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' C' ' 527' ' ' GLN . 15.0 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . 0.402 ' HA ' ' OE2' ' C' ' 538' ' ' GLU . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.628 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' C' ' 577' ' ' LEU . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.812 HD22 ' HE3' ' C' ' 581' ' ' LYS . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.403 ' O ' HG23 ' C' ' 582' ' ' VAL . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . 0.812 ' HE3' HD22 ' C' ' 577' ' ' LEU . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.403 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' C' ' 593' ' ' LYS . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' C' ' 590' ' ' GLU . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.435 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' B' ' 55' ' ' ILE . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.419 HG11 HD11 ' B' ' 100' ' ' ILE . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' D' ' 370' ' ' VAL . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.847 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 41' ' ' ARG . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' D' ' 468' ' ' CYS . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.407 HD13 HG11 ' B' ' 160' ' ' VAL . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.481 HD22 HD11 ' B' ' 6' ' ' LEU . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' B' ' 6' ' ' LEU . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.599 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.622 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.622 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.744 ' HE3' HG21 ' B' ' 103' ' ' VAL . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.857 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.796 ' HG ' HD22 ' B' ' 159' ' ' LEU . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.481 ' HB2' HD12 ' B' ' 113' ' ' LEU . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.589 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.477 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.897 HD11 ' HA ' ' B' ' 118' ' ' CYS . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.434 HD21 ' HB3' ' B' ' 88' ' ' LYS . 40.9 t30 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.434 ' HB3' HD21 ' B' ' 86' ' ' ASN . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . 0.521 ' HD2' ' HG2' ' B' ' 98' ' ' GLU . 1.8 t60 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.521 ' HG2' ' HD2' ' B' ' 94' ' ' HIS . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.578 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.419 HD11 HG11 ' B' ' 9' ' ' VAL . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.744 HG21 ' HE3' ' B' ' 72' ' ' MET . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.857 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.682 ' HB ' HD23 ' B' ' 79' ' ' LEU . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 80' ' ' CYS . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.457 HG22 ' HB ' ' B' ' 142' ' ' ILE . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.633 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.897 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.633 HD12 ' HB3' ' B' ' 117' ' ' LYS . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.517 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.733 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.733 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.566 ' HG2' HG13 ' B' ' 112' ' ' VAL . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' B' ' 114' ' ' VAL . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . 0.406 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.406 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.796 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.407 HG11 HD13 ' B' ' 46' ' ' ILE . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 161' ' ' ARG . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.606 HG22 ' HE2' ' B' ' 167' ' ' LYS . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.606 ' HE2' HG22 ' B' ' 163' ' ' ILE . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . 0.477 ' H ' HG13 ' D' ' 422' ' ' ILE . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.571 ' HD3' ' HE1' ' D' ' 361' ' ' PHE . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' D' ' 368' ' ' THR . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . 0.571 ' HE1' ' HD3' ' D' ' 359' ' ' ARG . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.988 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.583 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.988 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . 0.487 ' HB3' ' CE2' ' D' ' 361' ' ' PHE . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.477 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.847 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . 0.705 ' HA ' HD12 ' B' ' 36' ' ' ILE . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . 0.53 HG11 ' SG ' ' D' ' 381' ' ' CYS . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . 0.53 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . 0.648 HD21 ' HD3' ' D' ' 393' ' ' PRO . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . 0.463 ' HB2' ' HE3' ' D' ' 387' ' ' LYS . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 389' ' ' ARG . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . 0.648 ' HD3' HD21 ' D' ' 386' ' ' LEU . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . 0.497 ' HB3' HG12 ' D' ' 428' ' ' VAL . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . 0.688 ' HB2' HD23 ' D' ' 431' ' ' LEU . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . 0.401 HD13 ' HB2' ' D' ' 425' ' ' GLU . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' D' ' 411' ' ' ARG . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' D' ' 412' ' ' LEU . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . 0.477 HG13 ' H ' ' D' ' 357' ' ' THR . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.401 ' HB2' HD13 ' D' ' 401' ' ' LEU . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' D' ' 396' ' ' CYS . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' D' ' 397' ' ' ALA . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' D' ' 484' ' ' CYS . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' D' ' 465' ' ' CYS . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . 0.578 ' HG2' ' HD3' ' D' ' 464' ' ' ARG . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' D' ' 444' ' ' LYS . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' D' ' 464' ' ' ARG . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.417 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . 0.572 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.578 ' HD3' ' HG2' ' D' ' 444' ' ' LYS . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . 0.435 ' H ' ' HB2' ' D' ' 465' ' ' CYS . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.409 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.877 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . 0.572 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.877 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.519 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.445 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . 0.45 ' HA ' HD22 ' A' ' 206' ' ' ASN . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . 0.418 HE22 ' CD ' ' C' ' 553' ' ' GLU . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 221' ' ' LEU . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . 0.441 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.532 ' HG2' HE21 ' A' ' 241' ' ' GLN . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . 0.532 HE21 ' HG2' ' A' ' 237' ' ' GLU . 77.4 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.585 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.469 ' HA ' HG12 ' A' ' 250' ' ' VAL . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.723 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.723 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.445 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.445 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.456 ' O ' ' HD2' ' A' ' 261' ' ' PHE . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 254' ' ' VAL . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 257' ' ' TYR . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 266' ' ' GLN . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.481 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.683 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 262' ' ' GLN . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.514 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.536 ' HA ' HG12 ' A' ' 276' ' ' VAL . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.71 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.422 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 280' ' ' ARG . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 288' ' ' ARG . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . 0.423 HD23 HD12 ' A' ' 294' ' ' LEU . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.423 HD12 HD23 ' A' ' 291' ' ' LEU . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.596 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.558 HD13 ' HG2' ' C' ' 473' ' ' LYS . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.577 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 308' ' ' ARG . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.577 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.622 ' HA ' HD12 ' A' ' 316' ' ' LEU . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.487 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.584 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.584 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.51 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 352' ' ' LYS . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.612 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.805 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.805 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.428 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 382' ' ' PHE . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 384' ' ' VAL . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 378' ' ' VAL . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 380' ' ' GLU . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.546 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' C' ' 399' ' ' LEU . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 406' ' ' ASP . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 403' ' ' ASP . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.518 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 411' ' ' THR . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.45 ' HA ' ' HG2' ' C' ' 425' ' ' GLU . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' C' ' 422' ' ' VAL . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.638 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . 0.638 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' C' ' 446' ' ' GLU . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.442 ' O ' HG12 ' C' ' 448' ' ' VAL . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' C' ' 442' ' ' SER . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.442 HG12 ' O ' ' C' ' 445' ' ' LEU . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.416 HG23 HG22 ' C' ' 448' ' ' VAL . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.751 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.751 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.523 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' C' ' 460' ' ' GLN . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.558 ' HG2' HD13 ' A' ' 301' ' ' LEU . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' C' ' 486' ' ' ARG . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' C' ' 483' ' ' GLU . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . 0.433 ' HA ' ' OE1' ' C' ' 491' ' ' GLU . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' C' ' 488' ' ' LYS . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.697 ' HE3' HD22 ' A' ' 279' ' ' LEU . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.478 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.419 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.684 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.684 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.683 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.634 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.426 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.856 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.856 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.419 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.647 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.447 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' C' ' 522' ' ' SER . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.585 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.549 HD23 HD12 ' C' ' 536' ' ' LEU . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.436 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.549 HD12 HD23 ' C' ' 533' ' ' LEU . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' C' ' 544' ' ' LEU . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.601 ' HA ' ' HB2' ' C' ' 546' ' ' GLU . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' C' ' 540' ' ' GLY . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' C' ' 543' ' ' ARG . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.418 ' CD ' HE22 ' A' ' 220' ' ' GLN . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' C' ' 558' ' ' LEU . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . 0.474 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' C' ' 577' ' ' LEU . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.704 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.521 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' B' ' 79' ' ' LEU . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.423 HG21 HD11 ' B' ' 100' ' ' ILE . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HG3' ' B' ' 61' ' ' GLN . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.4 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.429 HG22 ' HD1' ' B' ' 40' ' ' TYR . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.805 HD13 HG13 ' D' ' 388' ' ' VAL . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.593 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.661 HD11 ' HB2' ' D' ' 371' ' ' ASN . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.652 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' B' ' 20' ' ' THR . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.416 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . 0.416 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.644 HD11 ' HG3' ' B' ' 37' ' ' GLU . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.4 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' HA3' ' B' ' 12' ' ' GLY . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' B' ' 68' ' ' ARG . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.554 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.825 ' HG ' HD22 ' B' ' 159' ' ' LEU . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.405 ' HB2' HD12 ' B' ' 113' ' ' LEU . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.749 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.542 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.975 HD11 ' HA ' ' B' ' 118' ' ' CYS . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.542 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.749 HD11 ' HB3' ' B' ' 82' ' ' PHE . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.515 ' O ' HG23 ' B' ' 103' ' ' VAL . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.423 HD11 HG21 ' B' ' 9' ' ' VAL . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' B' ' 107' ' ' GLU . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 99' ' ' GLN . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . 0.468 ' HA ' ' HE3' ' B' ' 101' ' ' LYS . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.554 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.683 ' HB ' HD23 ' B' ' 79' ' ' LEU . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 80' ' ' CYS . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.592 ' HB ' HG12 ' B' ' 81' ' ' VAL . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 144' ' ' THR . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' B' ' 120' ' ' LEU . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.975 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' B' ' 117' ' ' LYS . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.517 ' HG3' HD12 ' B' ' 84' ' ' ILE . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.693 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.43 HG23 ' HE2' ' B' ' 141' ' ' PHE . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.693 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.43 ' HE2' HG23 ' B' ' 127' ' ' THR . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.593 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . 0.439 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.461 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.825 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' B' ' 157' ' ' TYR . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.436 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' B' ' 161' ' ' ARG . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . 0.808 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . 0.808 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 38.0 mtmt . . . . . 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' D' ' 425' ' ' GLU . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . 0.411 ' HB3' ' HG3' ' D' ' 427' ' ' GLN . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.813 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.599 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.813 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 367' ' ' ARG . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.652 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.661 ' HB2' HD11 ' B' ' 36' ' ' ILE . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 373' ' ' ARG . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.488 HD12 ' HB ' ' D' ' 416' ' ' THR . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' D' ' 386' ' ' LEU . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' D' ' 382' ' ' LEU . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.805 HG13 HD13 ' B' ' 21' ' ' ILE . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . 0.529 ' NH2' ' HG2' ' D' ' 366' ' ' GLN . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . 0.462 ' HA ' ' CD2' ' D' ' 431' ' ' LEU . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.567 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.641 ' HA ' ' HG ' ' D' ' 426' ' ' LEU . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . 0.601 HD13 ' HG3' ' D' ' 425' ' ' GLU . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.418 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.567 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . 0.457 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' D' ' 412' ' ' LEU . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.488 ' HB ' HD12 ' D' ' 378' ' ' LEU . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' D' ' 401' ' ' LEU . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' D' ' 400' ' ' ARG . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' D' ' 361' ' ' PHE . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.462 ' CD2' ' HA ' ' D' ' 395' ' ' CYS . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.801 ' HA ' HD23 ' D' ' 459' ' ' LEU . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . 0.407 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.523 ' HG ' ' HG ' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.523 ' HG ' ' HG ' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.808 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.748 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . 0.477 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.748 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.695 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 210' ' ' VAL . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 206' ' ' ASN . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . 0.402 ' HA ' HD12 ' A' ' 221' ' ' LEU . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 218' ' ' ARG . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HE3' ' HA ' ' A' ' 229' ' ' TRP . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.797 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 232' ' ' LEU . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.416 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.797 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.471 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.936 ' HG3' HD12 ' A' ' 247' ' ' LEU . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 248' ' ' GLU . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.451 ' O ' ' HB ' ' A' ' 250' ' ' VAL . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.936 HD12 ' HG3' ' A' ' 243' ' ' MET . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' A' ' 244' ' ' SER . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.713 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.433 ' O ' HG12 ' A' ' 254' ' ' VAL . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.552 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . 0.42 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.553 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.453 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.585 ' HA ' HG12 ' A' ' 276' ' ' VAL . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.723 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 273' ' ' ARG . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.764 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.764 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.799 HD22 ' HE3' ' C' ' 495' ' ' LYS . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.769 HD13 ' HG2' ' C' ' 473' ' ' LYS . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . 0.43 ' SD ' HD13 ' C' ' 469' ' ' LEU . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.559 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . 0.671 ' HG3' HD21 ' C' ' 469' ' ' LEU . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 313' ' ' VAL . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' ' 316' ' ' LEU . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . 0.411 ' HA ' ' NH1' ' A' ' 317' ' ' ARG . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.459 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 314' ' ' ASP . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . 0.429 HD23 ' HD2' ' A' ' 330' ' ' ARG . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.78 HH21 ' HB3' ' C' ' 447' ' ' GLU . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . 0.412 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . 0.412 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . 0.407 ' HA2' HD12 ' A' ' 346' ' ' LEU . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . 0.407 HD12 ' HA2' ' A' ' 343' ' ' GLY . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.748 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.748 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 357' ' ' LEU . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' C' ' 414' ' ' LYS . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . 0.656 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.402 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.981 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.981 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 368' ' ' LEU . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 379' ' ' LEU . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . 0.467 ' HG2' ' HE3' ' C' ' 400' ' ' LYS . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 376' ' ' LEU . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . 0.621 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.659 ' HB2' ' HE3' ' C' ' 594' ' ' LYS . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 393' ' ' TYR . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 388' ' ' SER . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . 0.458 ' HD2' ' O ' ' A' ' 389' ' ' ALA . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . 0.467 ' HE3' ' HG2' ' A' ' 377' ' ' PRO . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 405' ' ' TRP . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.41 ' O ' HG23 ' C' ' 408' ' ' VAL . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . 0.447 ' HB2' ' HA ' ' C' ' 402' ' ' LEU . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.513 ' HB3' ' CG2' ' A' ' 359' ' ' THR . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' C' ' 413' ' ' SER . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.436 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.741 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.463 ' O ' HG12 ' C' ' 448' ' ' VAL . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.78 ' HB3' HH21 ' A' ' 330' ' ' ARG . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.769 HG22 HG23 ' C' ' 452' ' ' VAL . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.769 HG23 HG22 ' C' ' 448' ' ' VAL . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' C' ' 458' ' ' ASP . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . 0.435 ' O ' ' HB2' ' C' ' 467' ' ' MET . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.618 ' HA ' ' HG2' ' C' ' 475' ' ' GLU . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.769 ' HG2' HD13 ' A' ' 301' ' ' LEU . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.618 ' HG2' ' HA ' ' C' ' 471' ' ' ARG . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.68 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . 0.501 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.799 ' HE3' HD22 ' A' ' 279' ' ' LEU . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' C' ' 501' ' ' GLU . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' C' ' 497' ' ' SER . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.567 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.461 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.553 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.571 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.805 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.805 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.692 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.48 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . 0.67 HD23 HD12 ' C' ' 536' ' ' LEU . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.67 HD12 HD23 ' C' ' 533' ' ' LEU . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.513 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' C' ' 542' ' ' ALA . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' C' ' 576' ' ' VAL . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.444 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 578' ' ' GLU . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . 0.451 ' HD1' ' HA ' ' C' ' 591' ' ' TYR . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.659 ' HE3' ' HB2' ' A' ' 388' ' ' SER . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.486 ' HB ' ' HE2' ' B' ' 4' ' ' TYR . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.697 ' HG3' HD22 ' B' ' 52' ' ' LEU . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . 0.486 ' HE2' ' HB ' ' B' ' 2' ' ' THR . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.602 HD22 HD23 ' B' ' 159' ' ' LEU . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.463 HG11 ' HG3' ' B' ' 72' ' ' MET . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . 0.436 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.474 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.601 HD13 ' CG1' ' D' ' 388' ' ' VAL . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.533 HD22 HG12 ' B' ' 152' ' ' VAL . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . 0.416 HD12 ' HB2' ' B' ' 42' ' ' LYS . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . 0.454 ' O ' HG22 ' B' ' 21' ' ' ILE . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . 0.437 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.784 ' HB2' ' CG2' ' D' ' 369' ' ' VAL . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . 0.416 ' HB2' HD12 ' B' ' 24' ' ' ILE . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.56 ' HA ' ' HD2' ' D' ' 448' ' ' LYS . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . 0.611 ' HA2' ' CB ' ' D' ' 450' ' ' ALA . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 49' ' ' GLU . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.697 HD22 ' HG3' ' B' ' 3' ' ' GLU . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.542 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.463 ' HG3' HG11 ' B' ' 7' ' ' VAL . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.622 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.548 ' HG ' HD22 ' B' ' 159' ' ' LEU . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.412 ' HB2' HD12 ' B' ' 113' ' ' LEU . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' B' ' 93' ' ' ILE . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.543 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.994 HD11 ' HA ' ' B' ' 118' ' ' CYS . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.543 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.489 HD21 ' HB3' ' B' ' 88' ' ' LYS . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.489 ' HB3' HD21 ' B' ' 86' ' ' ASN . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.779 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 101' ' ' LYS . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.439 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.597 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 144' ' ' THR . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.442 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.994 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.424 HD12 ' HB3' ' B' ' 117' ' ' LYS . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . 0.486 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . 0.486 ' HE2' HG23 ' B' ' 127' ' ' THR . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.511 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . 0.533 HG12 HD22 ' B' ' 23' ' ' LEU . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.426 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.602 HD23 HD22 ' B' ' 6' ' ' LEU . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' B' ' 161' ' ' ARG . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 164' ' ' ARG . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . 0.435 ' O ' ' HG2' ' B' ' 170' ' ' MET . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 166' ' ' HIS . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . 0.456 ' HB2' ' HE3' ' B' ' 172' ' ' LYS . 34.7 mtmt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . 0.474 ' HA ' HD12 ' D' ' 422' ' ' ILE . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . 0.461 ' H ' HG13 ' D' ' 422' ' ' ILE . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.827 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.827 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 367' ' ' ARG . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.784 ' CG2' ' HB2' ' B' ' 37' ' ' GLU . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' D' ' 416' ' ' THR . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . 0.642 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.601 ' CG1' HD13 ' B' ' 21' ' ' ILE . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . 0.508 HD13 ' HZ ' ' D' ' 430' ' ' PHE . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' D' ' 411' ' ' ARG . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.497 ' CE2' ' HB3' ' D' ' 429' ' ' ASP . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' D' ' 425' ' ' GLU . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.527 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.439 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . 0.445 ' HD3' ' HB1' ' D' ' 397' ' ' ALA . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.504 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . 0.474 HD12 ' HA ' ' D' ' 356' ' ' ASN . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.525 ' HB2' HD13 ' D' ' 401' ' ' LEU . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.49 HD22 HD22 ' D' ' 378' ' ' LEU . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . 0.497 ' HB3' ' CE2' ' D' ' 399' ' ' PHE . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . 0.52 ' HE2' ' HG3' ' D' ' 363' ' ' PRO . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' D' ' 436' ' ' LEU . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . 0.447 ' CZ ' HD12 ' D' ' 459' ' ' LEU . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . 0.56 ' HD2' ' HA ' ' B' ' 47' ' ' ASP . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . 0.611 ' CB ' ' HA2' ' B' ' 48' ' ' GLY . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.503 ' CA ' HD23 ' D' ' 459' ' ' LEU . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . 0.485 HD11 ' HE2' ' D' ' 470' ' ' TYR . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.503 HD23 ' CA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' D' ' 442' ' ' ALA . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . 0.485 ' HE2' HD11 ' D' ' 454' ' ' ILE . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.4 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.903 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.563 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.441 HG12 ' O ' ' D' ' 476' ' ' CYS . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 203' ' ' LEU . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . 0.406 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 215' ' ' SER . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . 0.546 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . 0.459 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . 0.594 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.762 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.762 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.649 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.565 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.649 HD12 ' HG3' ' A' ' 243' ' ' MET . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.706 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.706 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.465 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . 0.407 ' HG2' ' NE2' ' A' ' 266' ' ' GLN . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.427 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 262' ' ' GLN . 38.5 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.545 ' HA ' HG12 ' A' ' 276' ' ' VAL . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.667 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 273' ' ' ARG . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.491 ' HA ' HD12 ' A' ' 283' ' ' LEU . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . 0.547 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 280' ' ' ARG . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.493 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.502 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 310' ' ' ARG . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 307' ' ' ASP . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . 0.408 HD21 ' HE3' ' C' ' 462' ' ' LYS . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.445 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . 0.46 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . 0.628 HH21 ' HB3' ' C' ' 447' ' ' GLU . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . 0.416 ' HD3' HH11 ' A' ' 334' ' ' ARG . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.482 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 363' ' ' LYS . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.462 ' HG3' ' HE3' ' C' ' 414' ' ' LYS . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.683 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.918 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.918 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 371' ' ' LEU . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 368' ' ' LEU . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.413 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.443 ' O ' HG23 ' A' ' 384' ' ' VAL . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 380' ' ' GLU . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . 0.584 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . 0.473 ' O ' HG23 ' C' ' 408' ' ' VAL . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 404' ' ' ASN . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.462 ' HE3' ' HG3' ' A' ' 362' ' ' GLU . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' C' ' 419' ' ' LEU . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' C' ' 416' ' ' ARG . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.482 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.597 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . 0.454 ' O ' HG12 ' C' ' 448' ' ' VAL . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.628 ' HB3' HH21 ' A' ' 330' ' ' ARG . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.597 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.454 HG23 ' O ' ' C' ' 448' ' ' VAL . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' C' ' 462' ' ' LYS . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.888 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.484 ' NZ ' HD22 ' C' ' 469' ' ' LEU . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.888 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . 0.675 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.566 ' HA ' HD13 ' C' ' 499' ' ' LEU . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.478 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' C' ' 495' ' ' LYS . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 497' ' ' SER . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.649 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.584 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.546 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.649 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.546 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.427 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.452 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.509 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . 0.473 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.711 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . 0.804 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . 0.804 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.565 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.785 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.408 ' HD2' ' HG ' ' C' ' 558' ' ' LEU . 2.5 t60 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' C' ' 558' ' ' LEU . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' C' ' 555' ' ' LEU . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . 0.531 ' HB2' ' HZ2' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . 0.407 HD23 HD12 ' C' ' 569' ' ' LEU . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . 0.407 HD12 HD23 ' C' ' 566' ' ' LEU . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' C' ' 577' ' ' LEU . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' C' ' 578' ' ' GLU . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . 0.584 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.49 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.744 HD23 ' HB2' ' B' ' 146' ' ' ALA . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.515 HD13 HG13 ' D' ' 388' ' ' VAL . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.676 HD11 ' HB2' ' D' ' 371' ' ' ASN . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.787 ' HB3' HG23 ' D' ' 369' ' ' VAL . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . 0.55 HG12 HH22 ' D' ' 464' ' ' ARG . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.655 HG21 HG21 ' B' ' 160' ' ' VAL . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.481 ' H ' ' HE1' ' B' ' 157' ' ' TYR . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.49 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.499 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . 0.429 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.642 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.642 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.457 ' HE3' HG21 ' B' ' 103' ' ' VAL . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.482 ' HB2' ' HG3' ' B' ' 111' ' ' MET . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' B' ' 112' ' ' VAL . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' B' ' 113' ' ' LEU . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.8 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.437 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.643 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.437 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . 0.452 HD21 ' HB3' ' B' ' 88' ' ' LYS . 52.5 t30 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . 0.452 ' HB3' HD21 ' B' ' 86' ' ' ASN . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.704 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.8 HD11 ' HB3' ' B' ' 82' ' ' PHE . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . 0.415 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.415 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.457 HG21 ' HE3' ' B' ' 72' ' ' MET . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.482 ' HG3' ' HB2' ' B' ' 78' ' ' PHE . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . 0.607 HG22 ' HG2' ' B' ' 140' ' ' PRO . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 80' ' ' CYS . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 142' ' ' ILE . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.452 ' HA ' HD11 ' B' ' 84' ' ' ILE . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD13 ' B' ' 84' ' ' ILE . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.471 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.471 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . 0.607 ' HG2' HG22 ' B' ' 112' ' ' VAL . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' B' ' 114' ' ' VAL . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . 0.744 ' HB2' HD23 ' B' ' 19' ' ' LEU . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . 0.705 ' HA ' ' HD2' ' B' ' 157' ' ' TYR . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' B' ' 154' ' ' ASP . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . 0.445 ' O ' HG13 ' B' ' 163' ' ' ILE . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . 0.655 HG21 HG21 ' B' ' 46' ' ' ILE . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt . . . . . 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.502 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.676 ' HB2' HD11 ' B' ' 36' ' ' ILE . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.681 HD21 HD12 ' D' ' 421' ' ' LEU . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . 0.524 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.515 HG13 HD13 ' B' ' 21' ' ' ILE . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . 0.471 ' CD2' ' HZ ' ' D' ' 430' ' ' PHE . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' D' ' 412' ' ' LEU . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' D' ' 409' ' ' LYS . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . 0.454 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . 0.748 ' HA ' HD11 ' D' ' 402' ' ' LEU . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 411' ' ' ARG . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . 0.567 HD12 ' HB3' ' D' ' 400' ' ' ARG . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . 0.448 ' O ' HD12 ' D' ' 378' ' ' LEU . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . 0.524 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . 0.681 HD12 HD21 ' D' ' 378' ' ' LEU . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.502 ' HG2' ' HD2' ' D' ' 359' ' ' ARG . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.555 HD22 HD22 ' D' ' 378' ' ' LEU . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . 0.471 ' HZ ' ' CD2' ' D' ' 391' ' ' LEU . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . 0.446 ' CE1' ' HB3' ' D' ' 465' ' ' CYS . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . 0.515 ' HZ ' ' HB3' ' D' ' 477' ' ' SER . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 443' ' ' ARG . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' D' ' 444' ' ' LYS . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . 0.614 ' HA ' HD23 ' D' ' 459' ' ' LEU . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' D' ' 476' ' ' CYS . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . 0.402 ' SG ' ' SG ' ' D' ' 476' ' ' CYS . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.487 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.487 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . 0.464 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . 0.55 HH22 HG12 ' B' ' 44' ' ' VAL . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.446 ' HB3' ' CE1' ' D' ' 439' ' ' HIS . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.721 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . 0.404 ' CE1' ' HB2' ' D' ' 452' ' ' CYS . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . 0.464 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' D' ' 479' ' ' LYS . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.721 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . 0.515 ' HB3' ' HZ ' ' D' ' 441' ' ' PHE . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.486 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 213' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 215' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 217' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 213' ' ' THR . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 219' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 215' ' ' SER . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 221' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 231' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 233' ' ' GLU . . . . . 0.622 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 234' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 236' ' ' THR . . . . . 0.622 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 237' ' ' GLU . . . . . 0.576 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 239' ' ' LEU . . . . . 0.493 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 240' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 242' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 243' ' ' MET . . . . . 0.683 ' HG3' HD12 ' A' ' 247' ' ' LEU . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 246' ' ' ASP . . . . . 0.708 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 247' ' ' LEU . . . . . 0.683 HD12 ' HG3' ' A' ' 243' ' ' MET . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 250' ' ' VAL . . . . . 0.574 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 254' ' ' VAL . . . . . 0.574 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 255' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 256' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 264' ' ' LYS . . . . . 0.659 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 265' ' ' TRP . . . . . 0.408 ' O ' ' HG2' ' A' ' 269' ' ' MET . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 269' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 265' ' ' TRP . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 272' ' ' TYR . . . . . 0.403 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 273' ' ' ARG . . . . . 0.553 ' HA ' HG12 ' A' ' 276' ' ' VAL . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 275' ' ' LYS . . . . . 0.601 ' HG2' HD21 ' C' ' 499' ' ' LEU . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 276' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 273' ' ' ARG . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 277' ' ' GLU . . . . . 0.42 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 278' ' ' PRO . . . . . 0.42 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 279' ' ' LEU . . . . . 0.842 HD22 ' HE3' ' C' ' 495' ' ' LYS . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 280' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 288' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 288' ' ' ARG . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 297' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' A' ' 297' ' ' LYS . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 298' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 299' ' ' SER . . . . . 0.515 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 300' ' ' PRO . . . . . 0.515 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 301' ' ' LEU . . . . . 0.489 HD13 ' HG2' ' C' ' 473' ' ' LYS . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 302' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 303' ' ' GLU . . . . . 0.435 ' HG2' ' NH1' ' A' ' 306' ' ' ARG . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 306' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 310' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 312' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 317' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 317' ' ' ARG . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 321' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 322' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 324' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 325' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 328' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 332' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 335' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 336' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 339' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 348' ' ' GLU . . . . . 0.505 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 352' ' ' LYS . . . . . 0.406 ' HG3' ' OE2' ' C' ' 425' ' ' GLU . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 363' ' ' LYS . . . . . 0.77 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 367' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 368' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.578 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 384' ' ' VAL . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 380' ' ' GLU . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' SER . . . . . 0.625 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 390' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 390' ' ' LEU . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 411' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 414' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 415' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' C' ' 411' ' ' THR . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 416' ' ' ARG . . . . . 0.46 HH11 ' HD2' ' C' ' 416' ' ' ARG . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 425' ' ' GLU . . . . . 0.406 ' OE2' ' HG3' ' A' ' 352' ' ' LYS . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 426' ' ' PHE . . . . . 0.581 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 427' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 428' ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 429' ' ' ASN . . . . . 0.505 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 430' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 431' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 432' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 435' ' ' GLU . . . . . 0.43 ' HA ' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 438' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' C' ' 435' ' ' GLU . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 439' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 440' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 443' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 444' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 447' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' C' ' 443' ' ' LYS . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 448' ' ' VAL . . . . . 0.451 HG23 ' O ' ' C' ' 444' ' ' ASP . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 451' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 452' ' ' VAL . . . . . 0.422 HG23 HG13 ' C' ' 448' ' ' VAL . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 454' ' ' PRO . . . . . 0.445 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 455' ' ' TYR . . . . . 0.615 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 457' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 461' ' ' LYS . . . . . 0.652 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 465' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 469' ' ' LEU . . . . . 0.621 HD22 ' HZ3' ' C' ' 473' ' ' LYS . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 471' ' ' ARG . . . . . 0.763 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 473' ' ' LYS . . . . . 0.621 ' HZ3' HD22 ' C' ' 469' ' ' LEU . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 475' ' ' GLU . . . . . 0.763 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 478' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' C' ' 478' ' ' ARG . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 495' ' ' LYS . . . . . 0.842 ' HE3' HD22 ' A' ' 279' ' ' LEU . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 496' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 497' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 498' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 499' ' ' LEU . . . . . 0.601 HD21 ' HG2' ' A' ' 275' ' ' LYS . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 500' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 501' ' ' GLU . . . . . 0.523 ' HA ' ' HD2' ' C' ' 504' ' ' ARG . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 502' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 503' ' ' MET . . . . . 0.475 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 504' ' ' ARG . . . . . 0.523 ' HD2' ' HA ' ' C' ' 501' ' ' GLU . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 505' ' ' ASP . . . . . 0.422 ' OD1' ' HD2' ' C' ' 508' ' ' ARG . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 506' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 508' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 509' ' ' ALA . . . . . 0.659 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 511' ' ' VAL . . . . . 0.617 ' HA ' HD12 ' C' ' 514' ' ' LEU . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 512' ' ' ASP . . . . . 0.738 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 514' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' C' ' 511' ' ' VAL . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 515' ' ' ARG . . . . . 0.738 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 519' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 520' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 525' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 528' ' ' ARG . . . . . 0.708 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 529' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 530' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 534' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 536' ' ' LEU . . . . . 0.435 ' O ' ' HA3' ' C' ' 540' ' ' GLY . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 540' ' ' GLY . . . . . 0.499 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 544' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 550' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 554' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 564' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 568' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 572' ' ' GLY . . . . . 0.509 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 576' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' C' ' 572' ' ' GLY . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 578' ' ' GLU . . . . . 0.497 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 582' ' ' VAL . . . . . 0.497 HG23 ' O ' ' C' ' 578' ' ' GLU . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 585' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' C' ' 585' ' ' LEU . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 594' ' ' LYS . . . . . 0.625 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.603 ' HA ' ' HB ' ' B' ' 50' ' ' THR . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.472 HD11 HD22 ' B' ' 53' ' ' LEU . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' VAL . . . . . 0.672 HG12 ' HB2' ' B' ' 79' ' ' LEU . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.42 HG21 HD11 ' B' ' 100' ' ' ILE . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.656 HG21 ' HB ' ' D' ' 388' ' ' VAL . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.767 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' B' ' 153' ' ' ASP . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' VAL . . . . . 0.508 HG12 HG11 ' D' ' 388' ' ' VAL . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' THR . . . . . 0.56 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.802 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ARG . . . . . 0.527 HH11 HD11 ' B' ' 52' ' ' LEU . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ILE . . . . . 0.715 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' B' ' 1' ' ' MET . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' CYS . . . . . 0.715 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' LEU . . . . . 0.638 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.472 HD22 HD11 ' B' ' 6' ' ' LEU . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ALA . . . . . 0.63 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' TYR . . . . . 0.451 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.626 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' TYR . . . . . 0.626 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' MET . . . . . 0.448 ' CE ' HG21 ' B' ' 103' ' ' VAL . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' B' ' 73' ' ' ARG . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' B' ' 111' ' ' MET . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.672 ' HB2' HG12 ' B' ' 8' ' ' VAL . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' CYS . . . . . 0.408 ' HB3' HD12 ' B' ' 93' ' ' ILE . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.633 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' PHE . . . . . 0.71 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ALA . . . . . 0.475 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' B' ' 118' ' ' CYS . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . 0.475 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' SER . . . . . 0.71 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . 0.512 HD11 ' HB3' ' B' ' 82' ' ' PHE . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' GLN . . . . . 0.466 ' O ' HG23 ' B' ' 103' ' ' VAL . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' ILE . . . . . 0.42 HD11 HG21 ' B' ' 9' ' ' VAL . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 99' ' ' GLN . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' VAL . . . . . 0.633 ' HB ' HG12 ' B' ' 81' ' ' VAL . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' ASN . . . . . 0.59 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' B' ' 120' ' ' LEU . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' CYS . . . . . 0.779 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' B' ' 117' ' ' LYS . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' ARG . . . . . 0.625 ' HG3' HD12 ' B' ' 84' ' ' ILE . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . 0.538 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . 0.538 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' SER . . . . . 0.59 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' ARG . . . . . 0.767 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' ASP . . . . . 0.458 ' HA ' HD11 ' B' ' 23' ' ' LEU . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' ILE . . . . . 0.556 HG22 ' HE2' ' B' ' 167' ' ' LYS . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' LYS . . . . . 0.556 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' GLU . . . . . 0.666 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' LYS . . . . . 0.666 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 55.3 mtmt . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 358' ' ' ILE . . . . . 0.516 ' O ' HG13 ' D' ' 369' ' ' VAL . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 359' ' ' ARG . . . . . 0.659 ' HA ' HG22 ' D' ' 369' ' ' VAL . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 361' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' D' ' 425' ' ' GLU . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 369' ' ' VAL . . . . . 0.802 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 371' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' B' ' 36' ' ' ILE . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 373' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' D' ' 373' ' ' ARG . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 378' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 426' ' ' LEU . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 384' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' D' ' 387' ' ' LYS . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 387' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' D' ' 384' ' ' LYS . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 388' ' ' VAL . . . . . 0.656 ' HB ' HG21 ' B' ' 21' ' ' ILE . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 389' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' D' ' 389' ' ' ARG . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 395' ' ' CYS . . . . . 0.464 ' O ' ' HA ' ' D' ' 430' ' ' PHE . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 399' ' ' PHE . . . . . 0.709 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 400' ' ' ARG . . . . . 0.465 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 410' ' ' ALA . . . . . 0.465 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 411' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' D' ' 411' ' ' ARG . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 416' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 425' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' D' ' 361' ' ' PHE . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 426' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 378' ' ' LEU . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 429' ' ' ASP . . . . . 0.709 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 430' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 437' ' ' THR . . . . . 0.525 ' HB ' HG21 ' D' ' 467' ' ' THR . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 440' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' D' ' 465' ' ' CYS . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 443' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' D' ' 443' ' ' ARG . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 446' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' D' ' 471' ' ' LYS . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 450' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 460' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' D' ' 461' ' ' ASN . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 461' ' ' ASN . . . . . 0.401 ' H ' ' HG ' ' D' ' 460' ' ' LEU . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 465' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 467' ' ' THR . . . . . 0.525 HG21 ' HB ' ' D' ' 437' ' ' THR . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 471' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' D' ' 450' ' ' ALA . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' D' D ' 472' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 473' ' ' HIS . . . . . 0.5 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 476' ' ' CYS . . . . . 0.692 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 480' ' ' VAL . . . . . 0.418 HG12 ' O ' ' D' ' 476' ' ' CYS . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 60.4 mt . . . . . 0 C--O 1.226 -0.136 0 CA-C-O 121.144 0.497 . . . . 10.0 110.25 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.2 tmtm? -53.63 -59.32 4.76 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.177 -0.92 . . . . 10.0 112.08 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 95.4 mt -70.96 -36.01 72.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.962 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 68.3 mt -66.23 -44.6 83.32 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.953 0.353 . . . . 10.0 111.953 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -68.76 -44.05 74.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.312 -0.404 . . . . 10.0 110.815 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.2 m120 -62.47 -38.95 91.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.115 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 47.1 t90 -66.36 -40.08 89.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.317 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -56.37 -40.13 74.06 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.805 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -34.11 76.18 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.125 0.488 . . . . 10.0 110.261 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 52.5 t -73.13 -37.12 52.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.76 -42.66 99.79 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.396 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -39.25 93.56 Favored 'General case' 0 N--CA 1.457 -0.1 0 N-CA-C 109.762 -0.459 . . . . 10.0 109.762 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 32.0 m -63.86 -43.39 96.24 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.112 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -42.37 97.61 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.01 0.433 . . . . 10.0 110.203 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.7 m -63.94 -41.62 97.57 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.264 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -64.51 -42.1 96.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.449 -0.574 . . . . 10.0 109.449 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 69.5 mt -61.61 -37.15 82.89 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.579 179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . 0.541 ' HA ' HD12 ' A' ' 221' ' ' LEU . 52.4 mtt180 -62.99 -39.79 95.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.481 -0.327 . . . . 10.0 110.526 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -70.99 -20.11 62.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.008 0.433 . . . . 10.0 110.999 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . 0.467 ' O ' HG23 ' A' ' 224' ' ' VAL . 7.0 tp-100 -91.19 -37.33 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.335 178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' A' ' 218' ' ' ARG . 19.6 mt -52.16 -45.04 64.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 115.817 -0.628 . . . . 10.0 111.572 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -50.94 -67.92 1.72 Allowed Glycine 0 C--N 1.33 0.231 0 O-C-N 123.932 0.77 . . . . 10.0 112.04 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -52.73 -39.8 75.75 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.779 2.319 . . . . 10.0 111.378 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.67 HG22 ' HD3' ' C' ' 550' ' ' LYS . 55.5 t -59.08 -52.74 57.12 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 CA-C-N 116.541 -0.299 . . . . 10.0 111.097 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -67.1 -36.62 82.33 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.899 -0.32 . . . . 10.0 110.734 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -63.19 -43.55 97.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.361 -0.382 . . . . 10.0 111.135 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -76.2 -39.63 54.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.537 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' A' ' 224' ' ' VAL . 0.2 OUTLIER -63.34 -44.8 93.85 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.415 179.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -66.45 -32.16 73.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.898 0.38 . . . . 10.0 110.193 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.21 -45.7 76.05 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.621 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 73.3 m-20 -68.51 -39.54 81.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.352 -0.84 . . . . 10.0 109.614 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 19.9 mt -61.75 -36.5 81.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.126 -0.488 . . . . 10.0 109.959 178.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 6.2 mm-40 -65.2 -35.32 80.71 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.183 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.621 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 66.3 mttt -67.03 -39.34 86.96 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.983 -0.747 . . . . 10.0 108.983 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.44 -50.48 67.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.144 -0.934 . . . . 10.0 109.763 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.7 p -66.32 -38.82 88.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 116.026 -0.534 . . . . 10.0 110.753 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 30.5 tt0 -58.77 -47.89 83.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.679 -0.489 . . . . 10.0 109.679 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.74 -41.23 98.97 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.368 -1.093 . . . . 10.0 110.368 178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.439 HD13 H441 ' A' ' 404' ' ' PCW . 84.9 mt -68.18 -28.59 67.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.793 -0.203 . . . . 10.0 111.06 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 65.5 mtt180 -69.66 -39.44 77.04 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -74.46 -32.6 62.66 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.41 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 23.2 mt-10 -72.56 -24.42 61.12 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.471 -0.786 . . . . 10.0 109.362 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 56.6 ttm -66.2 -28.25 68.61 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.2 m -77.29 6.81 6.09 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.997 178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 67.4 mttm -127.95 -54.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.555 -0.905 . . . . 10.0 108.555 178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.652 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.8 OUTLIER -57.9 -60.63 3.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.559 -0.746 . . . . 10.0 111.334 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 250' ' ' VAL . 26.9 mt -75.38 -44.25 45.86 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.046 0.388 . . . . 10.0 112.046 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 68.6 mm-40 -57.04 -54.62 44.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.578 -0.283 . . . . 10.0 111.723 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 18.7 mt-10 -70.18 -31.88 69.55 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 10.0 111.719 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.805 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.5 OUTLIER -66.55 -31.31 52.99 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.289 0 C-N-CA 120.284 -0.566 . . . . 10.0 110.808 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.478 ' O ' HG12 ' A' ' 254' ' ' VAL . 54.8 mtpt -86.92 -35.26 19.03 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.206 0.527 . . . . 10.0 110.28 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -69.2 -41.3 77.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.521 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -88.32 -10.6 48.96 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.058 -0.519 . . . . 10.0 111.798 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.805 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.6 OUTLIER -68.12 -28.88 42.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.204 0 C-N-CA 120.9 -0.32 . . . . 10.0 110.574 179.461 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.464 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 18.4 mt-30 -60.05 -61.07 8.64 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.987 -0.551 . . . . 10.0 111.428 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 23.0 Cg_endo -63.66 -31.65 69.61 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.569 1.513 . . . . 10.0 111.499 178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -66.02 -55.55 16.11 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.126 0.489 . . . . 10.0 110.337 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.467 ' HG ' HG22 ' A' ' 254' ' ' VAL . 67.4 mt -62.54 -44.34 96.58 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.287 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -58.54 -42.14 87.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.348 -0.387 . . . . 10.0 111.35 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.43 -54.11 37.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.931 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -62.77 -40.25 96.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.011 -0.541 . . . . 10.0 111.318 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.65 -43.75 88.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.298 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -45.11 95.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.665 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 79.3 mttt -65.84 -40.62 91.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.37 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -62.72 -40.64 97.81 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.718 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -63.26 -39.77 95.53 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -65.82 -40.8 92.17 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.444 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 34.0 mt-10 -63.83 -41.48 97.83 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.296 -0.866 . . . . 10.0 110.135 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 53.2 mmm -66.75 -41.91 87.04 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -60.75 -49.33 77.93 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.812 178.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 63.5 mt -62.63 -39.85 95.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.761 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -41.01 95.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.298 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.449 HH11 ' HD2' ' A' ' 273' ' ' ARG . 60.0 mtt85 -70.81 -38.25 73.27 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.982 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -70.89 -20.62 62.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.045 0.45 . . . . 10.0 111.076 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.718 ' HG2' HD21 ' C' ' 499' ' ' LEU . 7.3 mptt -96.31 -39.09 9.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.105 -0.498 . . . . 10.0 111.275 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -58.72 -29.34 39.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.244 0.461 . . . . 10.0 112.244 -179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.458 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 68.8 mt-10 -65.53 -62.96 3.82 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 112.127 0.418 . . . . 10.0 112.127 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.575 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 36.5 Cg_endo -67.02 -36.55 21.87 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 121.867 1.712 . . . . 10.0 112.555 179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 57.4 mt -64.19 -41.9 96.89 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.679 0.276 . . . . 10.0 110.972 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 33.0 ttm180 -68.1 -26.15 65.67 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.048 0.451 . . . . 10.0 109.819 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.37 -45.77 68.57 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.37 -0.604 . . . . 10.0 109.37 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.575 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 8.1 mt-10 -63.64 -41.49 98.23 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.621 -0.881 . . . . 10.0 108.621 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.6 -42.38 98.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.084 -0.962 . . . . 10.0 110.309 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -70.73 -48.21 55.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.248 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -60.66 -43.23 97.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.807 -0.442 . . . . 10.0 109.807 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -67.06 -42.77 91.94 Favored Glycine 0 N--CA 1.44 -1.092 0 N-CA-C 110.657 -0.977 . . . . 10.0 110.657 178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.86 95.39 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -57.38 -48.74 78.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.403 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.41 -46.08 84.81 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.731 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 55.7 mttt -64.52 -43.47 93.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.584 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.32 -42.69 83.22 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.378 -0.23 . . . . 10.0 110.378 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -63.53 -41.21 98.48 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.771 -0.455 . . . . 10.0 109.771 178.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -40.57 89.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.229 0.537 . . . . 10.0 109.576 178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 96.9 mt -66.54 -41.28 88.96 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.707 -0.679 . . . . 10.0 109.594 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -62.2 -37.47 85.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.57 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -63.61 -14.09 48.32 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.637 -0.71 . . . . 10.0 110.835 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.464 ' HB3' HD12 ' A' ' 301' ' ' LEU . 12.0 mmtp -107.09 -39.6 5.68 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 71.0 mt -61.17 -27.98 68.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.894 -0.594 . . . . 10.0 112.142 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.527 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 17.4 m -77.04 -65.78 0.36 Allowed Pre-proline 0 N--CA 1.45 -0.434 0 N-CA-C 112.117 0.414 . . . . 10.0 112.117 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -66.54 -50.3 1.37 Allowed 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.712 1.608 . . . . 10.0 112.795 -179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.534 HD13 ' HG2' ' C' ' 473' ' ' LYS . 96.1 mt -68.23 -29.16 67.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.847 0.356 . . . . 10.0 110.196 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -68.64 -46.47 61.62 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.66 -38.78 92.17 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . 0.406 ' OE2' HD22 ' C' ' 469' ' ' LEU . 0.0 OUTLIER -62.29 -43.39 98.93 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.573 178.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 14.2 tpt -60.26 -38.03 82.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.134 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 10.8 mtt180 -67.91 -42.33 81.29 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 10.0 109.534 178.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 34.2 t70 -66.7 -41.1 88.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.366 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.431 ' HG3' HD11 ' C' ' 469' ' ' LEU . 25.8 mmt180 -66.39 -37.58 85.58 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.26 -0.645 . . . . 10.0 109.26 178.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.56 79.83 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.225 -0.658 . . . . 10.0 109.225 178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.664 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 88.0 mtt180 -57.79 -49.49 76.45 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 109.254 -0.647 . . . . 10.0 109.254 178.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.18 77.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.784 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -58.36 -47.55 83.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.047 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.7 t -75.05 -33.23 28.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.407 -0.815 . . . . 10.0 110.47 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -59.34 -51.07 71.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.613 -0.514 . . . . 10.0 109.613 179.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 319' ' ' HIS . . . -62.32 -35.61 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.288 -0.869 . . . . 10.0 109.953 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 14.2 mt -65.99 -47.37 74.76 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.171 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 45.9 mtm105 -65.31 -48.35 73.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.763 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 14.8 m -60.38 -37.19 79.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.014 -0.539 . . . . 10.0 111.477 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 315' ' ' ALA . 1.7 m170 -79.68 -38.61 33.2 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 121.0 -0.28 . . . . 10.0 111.339 179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 16.3 mt -72.72 -21.36 61.05 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.055 0.391 . . . . 10.0 112.055 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.412 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.13 -60.88 7.63 Favored Pre-proline 0 CA--C 1.536 0.406 0 N-CA-C 111.72 0.267 . . . . 10.0 111.72 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 40.9 Cg_endo -68.98 -31.33 24.24 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.347 1.365 . . . . 10.0 110.529 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.469 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 11.7 m-30 -61.5 -49.32 77.23 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.458 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 5.1 p -61.61 -41.68 97.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.778 0.323 . . . . 10.0 110.888 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.762 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.0 t70 -66.35 -38.7 88.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.994 0.426 . . . . 10.0 110.377 179.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -68.59 -34.26 75.48 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 60.7 mt -65.38 -35.44 80.96 Favored 'General case' 0 C--O 1.222 -0.351 0 N-CA-C 108.776 -0.824 . . . . 10.0 108.776 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 71.6 mtt180 -64.99 -41.4 95.44 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 108.593 -0.892 . . . . 10.0 108.593 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -68.03 -35.96 79.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.435 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.4 ' HD3' HH11 ' A' ' 330' ' ' ARG . 37.7 mtt-85 -66.09 -50.21 64.89 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.774 -0.824 . . . . 10.0 108.774 178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 52.8 mt -57.92 -41.54 82.93 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.316 -0.857 . . . . 10.0 110.694 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -57.42 -50.03 74.34 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.773 -0.454 . . . . 10.0 109.773 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.38 -40.65 93.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.692 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -62.24 -49.21 76.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.639 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 80.1 mt -68.29 -43.71 77.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.913 -0.585 . . . . 10.0 111.701 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -64.22 -38.76 92.18 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 121.382 -0.127 . . . . 10.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.49 -44.31 97.32 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 338' ' ' LEU . 15.8 mt -75.71 -13.71 60.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.127 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -83.77 -49.48 9.05 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.24 -47.35 79.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.861 -0.792 . . . . 10.0 108.861 179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -70.28 -34.02 72.27 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.46 -0.791 . . . . 10.0 109.484 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.67 -42.76 99.81 Favored Glycine 0 N--CA 1.448 -0.5 0 CA-C-N 115.545 -0.752 . . . . 10.0 111.898 179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -60.32 -40.46 97.49 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 110.224 -1.15 . . . . 10.0 110.224 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.94 -44.06 86.16 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 109.975 -0.38 . . . . 10.0 109.975 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -62.91 -41.33 99.42 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.894 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.54 -44.47 90.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.26 -47.3 86.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.757 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -64.35 -42.06 96.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.78 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -61.99 -39.47 92.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.825 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -65.73 -42.16 91.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 10.0 109.755 178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.8 72.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.77 -0.65 . . . . 10.0 109.87 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 11.6 mtmm -60.53 -40.22 90.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.61 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.533 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -64.15 -44.73 91.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.174 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 28.5 m -62.19 -41.45 98.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.609 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -68.95 -28.97 67.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.334 0.587 . . . . 10.0 110.408 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.414 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 43.4 t60 -76.67 -29.87 56.55 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.195 178.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.4 mt -74.2 -34.8 63.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.965 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.95 -42.29 76.86 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.535 -0.543 . . . . 10.0 109.535 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.4 p -70.36 -29.56 66.26 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 363' ' ' LYS . 16.2 tp -71.03 -30.6 66.84 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 108.631 -0.878 . . . . 10.0 108.631 178.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . 0.57 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 50.7 m -66.31 -33.28 75.39 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 115.758 -0.655 . . . . 10.0 109.694 179.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -67.74 -18.9 65.05 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.14 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.67 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.3 mttt -94.79 -40.03 9.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.247 -0.649 . . . . 10.0 109.247 178.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . 0.721 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -70.6 -32.82 70.33 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.372 -0.831 . . . . 10.0 112.898 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.982 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 47.1 mttt -102.0 -72.97 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.515 0 N-CA-C 113.209 0.818 . . . . 10.0 113.209 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.982 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -61.17 -54.93 1.48 Allowed 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.176 1.917 . . . . 10.0 113.099 -179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.67 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.63 -54.36 46.28 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.323 0.49 . . . . 10.0 112.323 -178.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 364' ' ' ALA . 9.8 mt -58.25 -39.74 79.95 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 2.5 tp10 -60.36 -50.14 74.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.066 0.46 . . . . 10.0 109.807 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -64.42 -33.93 77.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.913 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 66.6 mt -66.66 -45.25 79.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.136 -0.483 . . . . 10.0 110.039 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.599 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 42.9 mtt85 -67.23 -50.12 61.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.705 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 376' ' ' LEU . 94.8 mt-30 -62.5 -28.75 70.05 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.247 -0.433 . . . . 10.0 111.042 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.26 -37.51 21.06 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.906 -0.664 . . . . 10.0 111.501 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 20.5 mt -73.87 -24.4 59.73 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.906 0.336 . . . . 10.0 111.906 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 83.3 mt -51.74 -60.12 6.66 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.965 0.728 . . . . 10.0 112.965 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -63.42 -28.69 71.35 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.779 1.653 . . . . 10.0 111.094 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 87.6 t -67.43 -44.72 86.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.461 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 98.3 mt -66.48 -37.21 84.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 10.0 109.893 179.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 384' ' ' VAL . 88.2 mt-10 -62.95 -50.41 70.93 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.397 179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 4.7 p -64.67 -33.8 76.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -43.63 98.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.33 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 93.8 mttt -60.07 -38.22 82.21 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.146 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 380' ' ' GLU . 59.9 t -62.08 -51.69 69.47 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.515 . . . . 10.0 109.845 179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.68 -40.42 92.09 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.421 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -64.47 -39.73 94.37 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.82 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.36 -49.71 74.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.296 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.92 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.7 p -63.49 -34.79 78.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.936 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -68.0 -35.27 78.05 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.955 0.407 . . . . 10.0 110.218 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 27.7 mt -62.6 -44.4 96.4 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -62.08 -44.15 97.29 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.99 -1.005 . . . . 10.0 110.008 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 388' ' ' SER . 37.8 mm-40 -55.4 -41.04 72.18 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.77 0.319 . . . . 10.0 111.293 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -63.42 -50.32 70.3 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.967 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.9 m -71.54 -24.75 62.0 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.7 0.63 . . . . 10.0 112.7 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.24 -26.42 39.08 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.392 0.515 . . . . 10.0 112.392 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.806 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -108.43 -32.58 7.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 113.024 0.75 . . . . 10.0 113.024 -178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 13.1 mt -97.91 9.15 43.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.757 0.313 . . . . 10.0 111.339 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 55.3 t30 . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.51 179.719 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 CA--C 1.52 -0.196 0 CA-C-O 121.057 0.456 . . . . 10.0 110.379 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . 0.42 ' HB3' ' HB2' ' C' ' 403' ' ' ASP . 19.8 mtpt -96.62 36.97 1.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.505 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 88.1 mt -64.22 -33.97 77.02 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.771 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 84.0 mt -76.32 -29.18 57.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.486 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' C' ' 400' ' ' LYS . 2.0 m-20 -65.13 -44.91 87.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.354 0.597 . . . . 10.0 109.536 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.416 ' O ' HG23 ' C' ' 408' ' ' VAL . 26.5 t-20 -68.99 -43.4 74.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.319 -0.855 . . . . 10.0 109.383 179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -59.43 -33.51 71.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.683 -0.69 . . . . 10.0 110.539 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -63.04 -51.11 68.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.055 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 3.3 m -59.72 -40.95 89.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.493 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.416 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.0 t -61.61 -42.64 94.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.591 -0.522 . . . . 10.0 109.591 178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 33.1 m -65.28 -33.67 76.52 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.686 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 14.7 m -62.17 -39.54 93.02 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.645 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -61.49 -42.15 98.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.424 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.459 ' HD1' HD12 ' C' ' 415' ' ' LEU . 17.4 m-85 -62.86 -38.88 92.58 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 116.059 -0.518 . . . . 10.0 109.674 178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 12.9 m -64.1 -39.87 94.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.313 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 55.6 mmtt -66.95 -34.85 78.68 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.707 178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' C' ' 411' ' ' THR . 85.8 mt -63.26 -42.2 99.12 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -65.07 -37.45 87.56 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.855 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.59 -30.51 71.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.748 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -84.38 -45.03 13.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.998 -0.546 . . . . 10.0 109.621 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 13.6 mt -44.84 -50.11 10.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 115.554 -0.748 . . . . 10.0 112.692 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.09 -76.52 0.17 Allowed Glycine 0 C--O 1.228 -0.267 0 C-N-CA 121.005 -0.617 . . . . 10.0 112.803 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.549 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 71.2 Cg_exo -52.22 -44.54 45.44 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.911 2.407 . . . . 10.0 112.572 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.0 t -57.56 -51.96 63.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 111.897 0.332 . . . . 10.0 111.897 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.9 p -65.09 -32.94 74.89 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.957 -0.297 . . . . 10.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.81 -53.19 54.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.733 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.3 pt-20 -71.57 -31.96 67.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 10.0 110.8 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.473 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 26.1 t80 -67.75 -34.91 77.75 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.425 -0.583 . . . . 10.0 109.425 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.486 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 0.0 OUTLIER -64.21 -46.7 82.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.602 -0.888 . . . . 10.0 108.602 178.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 19.7 t70 -64.78 -36.24 83.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.02 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.38 -44.63 96.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.163 177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 93.8 mt -62.18 -37.52 85.59 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.668 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 8.7 mm-40 -67.52 -38.37 84.15 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 48.7 mttp -62.68 -45.74 91.39 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 108.757 -0.831 . . . . 10.0 108.757 178.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.4 mt-10 -66.65 -49.42 66.26 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.116 -0.947 . . . . 10.0 111.56 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 6.2 p -58.66 -50.54 73.48 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.664 -0.414 . . . . 10.0 111.163 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.429 ' HA ' ' OE1' ' C' ' 435' ' ' GLU . 8.8 mm-40 -65.37 -38.86 91.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.846 0.355 . . . . 10.0 110.676 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.16 -46.11 91.91 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 110.877 -0.889 . . . . 10.0 110.877 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' C' ' 440' ' ' GLU . 81.0 mt -65.88 -33.13 75.13 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.476 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 36.5 mtt180 -65.05 -28.85 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.068 179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 65.4 mt-30 -62.9 -44.74 95.28 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.651 -0.5 . . . . 10.0 109.651 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' C' ' 437' ' ' LEU . 0.0 OUTLIER -81.23 -35.73 30.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.877 179.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . 0.476 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 78.4 mmm -61.61 -47.19 86.55 Favored 'General case' 0 CA--C 1.52 -0.173 0 CA-C-N 116.126 -0.488 . . . . 10.0 112.084 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.9 p -56.91 -46.25 82.11 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -62.77 -47.7 82.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.039 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.732 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.4 t70 -59.45 -45.53 91.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.765 -179.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.563 ' O ' HG12 ' C' ' 448' ' ' VAL . 92.8 mt -69.48 -47.56 63.54 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.305 0.483 . . . . 10.0 112.305 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -69.19 -37.63 78.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 10.0 112.087 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.79 -21.36 41.01 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.409 -0.36 . . . . 10.0 111.07 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.732 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.4 OUTLIER -66.59 -23.08 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 121.256 0.551 . . . . 10.0 109.844 178.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -66.06 -36.55 83.53 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.497 -0.927 . . . . 10.0 108.497 177.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -90.33 22.11 3.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.04 -0.982 . . . . 10.0 109.354 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.585 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 25.7 mmtm -129.23 -61.01 1.05 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.263 -0.881 . . . . 10.0 109.644 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.615 HG23 HG22 ' C' ' 448' ' ' VAL . 97.2 t -62.76 -46.64 95.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 10.0 111.783 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -56.64 -59.8 11.19 Favored Pre-proline 0 CA--C 1.534 0.355 0 N-CA-C 112.451 0.537 . . . . 10.0 112.451 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.85 -31.78 67.42 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.883 1.722 . . . . 10.0 111.792 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.585 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.8 t80 -69.06 -39.22 79.24 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.954 0.407 . . . . 10.0 110.12 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.451 ' HA ' HD23 ' C' ' 456' ' ' LEU . 15.4 mt -68.64 -34.2 75.32 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -69.02 -47.54 65.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.62 -0.718 . . . . 10.0 109.276 178.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -61.02 -42.62 98.81 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.475 -0.784 . . . . 10.0 110.124 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.48 ' CE1' H281 ' C' ' 602' ' ' PCW . 1.5 m-85 -67.54 -46.77 71.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.482 -0.781 . . . . 10.0 110.958 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -60.72 -34.26 74.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 116.563 -0.289 . . . . 10.0 110.867 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -63.51 -42.03 98.5 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -71.68 -34.06 69.35 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.873 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.481 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 45.2 m0 -67.44 -43.53 80.9 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.524 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -63.19 -45.41 91.88 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 109.387 -0.597 . . . . 10.0 109.387 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.634 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 27.5 mt-10 -55.26 -56.24 22.26 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.726 178.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -41.64 88.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.42 -0.809 . . . . 10.0 111.25 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.4 ttm -59.25 -45.8 90.2 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.953 0.406 . . . . 10.0 110.525 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -67.84 -38.3 82.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.979 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 65.4 mt -65.85 -34.01 77.15 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.564 179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -66.22 -30.76 71.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.244 0.545 . . . . 10.0 109.598 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.644 ' HA ' ' CG ' ' C' ' 475' ' ' GLU . 74.3 mtt180 -77.89 -15.69 58.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.109 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -106.84 -0.2 23.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.855 -0.612 . . . . 10.0 110.478 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.534 ' HG2' HD13 ' A' ' 301' ' ' LEU . 86.3 mttt -128.08 -67.04 0.83 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.024 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.62 -45.58 97.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 111.961 0.356 . . . . 10.0 111.961 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.644 ' CG ' ' HA ' ' C' ' 471' ' ' ARG . 10.1 mm-40 -56.97 -56.8 29.58 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 111.837 0.31 . . . . 10.0 111.837 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -65.69 -32.31 47.6 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 121.27 1.314 . . . . 10.0 111.34 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' C' ' 477' ' ' LEU . 16.7 mt -66.39 -28.72 68.85 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' C' ' 475' ' ' GLU . 35.5 mtt180 -65.06 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 177.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -72.23 -41.16 67.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.189 -1.041 . . . . 10.0 108.189 178.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -39.69 93.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 26.3 mt -66.82 -43.9 82.6 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.246 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.417 ' HB3' ' NH1' ' C' ' 486' ' ' ARG . 35.5 mt-30 -59.1 -48.72 80.56 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.952 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -64.33 -44.85 90.26 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.354 -0.385 . . . . 10.0 110.439 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -60.52 -42.37 99.08 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.16 -42.96 75.22 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 110.053 -0.351 . . . . 10.0 110.053 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . 0.417 ' NH1' ' HB3' ' C' ' 482' ' ' GLN . 57.6 mtt180 -60.34 -42.28 95.34 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.79 0.329 . . . . 10.0 110.457 179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -65.98 -41.18 91.48 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -66.62 -38.29 86.64 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.688 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.82 -40.72 95.66 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -64.35 -43.44 94.56 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.99 -38.83 90.07 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.693 -0.854 . . . . 10.0 108.693 178.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . 0.57 ' O ' ' HG ' ' C' ' 496' ' ' LEU . 48.4 mt -69.52 -42.61 74.46 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.595 -0.73 . . . . 10.0 111.175 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -57.69 -40.89 80.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.785 0.326 . . . . 10.0 110.456 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -77.21 9.13 3.3 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.097 0.475 . . . . 10.0 111.196 178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.437 ' HE3' HD22 ' A' ' 279' ' ' LEU . 56.7 mttp -125.42 -55.52 1.54 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.268 179.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' C' ' 492' ' ' LEU . 30.2 mt -55.98 -39.26 71.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.774 -179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.78 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 1.5 m -73.83 -62.39 1.12 Allowed Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 111.973 0.36 . . . . 10.0 111.973 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.78 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.4 Cg_exo -59.59 -52.69 4.24 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.211 1.941 . . . . 10.0 112.303 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 275' ' ' LYS . 52.8 mt -67.65 -27.88 67.24 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 110.163 -0.31 . . . . 10.0 110.163 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -67.13 -48.62 58.51 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.413 -1.075 . . . . 10.0 110.413 178.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -64.39 -38.64 91.76 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.801 -0.814 . . . . 10.0 108.801 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 20.4 tt0 -63.25 -45.23 92.52 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.505 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 59.9 mmm -63.2 -40.75 98.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.742 0.306 . . . . 10.0 110.411 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -64.38 -38.24 90.35 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.482 -0.562 . . . . 10.0 109.482 178.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' C' ' 508' ' ' ARG . 24.0 t70 -69.26 -37.42 77.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.79 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 54.8 mtt180 -63.01 -47.3 83.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 107.549 -1.278 . . . . 10.0 107.549 177.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.1 -36.14 74.65 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.009 -0.996 . . . . 10.0 110.208 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' C' ' 505' ' ' ASP . 66.0 mtt180 -58.34 -51.66 68.86 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.665 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.23 -31.26 71.79 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.076 -0.965 . . . . 10.0 111.151 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.558 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 57.4 m-70 -76.91 -51.96 10.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.774 0.321 . . . . 10.0 111.072 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.83 -43.74 97.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.864 0.364 . . . . 10.0 110.369 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.524 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 5.8 t70 -65.32 -35.02 79.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.289 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . 0.431 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -67.17 -41.81 85.32 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 108.927 -0.768 . . . . 10.0 108.927 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 82.5 mt -61.56 -24.09 66.41 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.215 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.524 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 67.0 mtt180 -71.96 -22.47 61.45 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.088 178.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.45 -8.81 14.98 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.139 0.495 . . . . 10.0 110.097 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 28.6 m170 -104.67 -63.76 1.18 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.66 -179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 48.2 mt -76.58 -49.99 14.98 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.591 0.589 . . . . 10.0 112.591 -178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.677 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -48.5 -58.95 6.92 Favored Pre-proline 0 N--CA 1.468 0.459 0 N-CA-C 113.414 0.894 . . . . 10.0 113.414 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 32.2 Cg_exo -62.79 -37.57 54.81 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.859 1.706 . . . . 10.0 111.228 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.427 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 2.6 t80 -64.25 -33.29 75.47 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.659 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 16.9 m -61.98 -34.6 76.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.091 -0.707 . . . . 10.0 109.091 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.602 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 23.6 t70 -77.17 -40.24 46.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.388 178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 48.3 mt-10 -63.12 -36.59 84.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.571 0.7 . . . . 10.0 109.158 178.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 18.2 mt -67.01 -29.44 69.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.392 -0.822 . . . . 10.0 109.958 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.602 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 61.2 mtt180 -63.63 -38.22 90.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.178 -0.464 . . . . 10.0 110.492 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -63.92 -44.31 93.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.103 -0.702 . . . . 10.0 109.103 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.652 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.2 mtt180 -67.24 -45.94 75.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.522 -0.763 . . . . 10.0 109.563 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.71 -34.42 75.75 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.635 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -65.63 -42.95 90.91 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.549 -0.537 . . . . 10.0 109.549 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.48 82.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.648 -0.705 . . . . 10.0 109.345 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.572 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 11.3 ttm180 -62.22 -46.34 89.29 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -35.89 82.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.187 178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.458 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 13.4 tt0 -65.32 -43.04 92.28 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . 0.515 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -62.8 -44.25 96.66 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.966 -0.753 . . . . 10.0 108.966 178.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 84.7 mt -66.84 -24.34 66.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.684 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.458 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 42.9 mtmt -79.95 -46.94 15.8 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.469 -0.332 . . . . 10.0 110.127 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -65.5 -46.37 79.95 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.7 t30 -68.57 -32.97 73.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.445 -0.798 . . . . 10.0 109.266 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -68.69 -43.65 74.71 Favored Glycine 0 N--CA 1.445 -0.718 0 CA-C-N 115.346 -0.843 . . . . 10.0 111.402 178.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.01 -40.19 98.57 Favored Glycine 0 C--N 1.332 0.328 0 N-CA-C 110.031 -1.228 . . . . 10.0 110.031 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.89 -47.85 73.44 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 47.0 mtt85 -60.47 -39.44 87.61 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.614 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 44.0 mt -61.78 -45.85 92.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.814 0.34 . . . . 10.0 110.189 179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -63.72 -44.25 94.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.183 179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -65.95 -43.53 87.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.866 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.45 -44.23 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.332 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -64.31 -40.99 97.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.114 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.1 77.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.979 -0.555 . . . . 10.0 109.937 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.67 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -67.02 -25.22 66.18 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.442 179.647 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.16 85.37 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.872 -0.788 . . . . 10.0 108.872 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -39.73 87.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.352 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.19 -43.96 98.05 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.884 -0.598 . . . . 10.0 109.799 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -67.02 -36.66 82.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.222 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.4 tp -62.17 -43.55 98.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.77 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -40.75 87.56 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.843 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -40.09 78.15 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.861 0.362 . . . . 10.0 110.193 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 32.2 mt -64.09 -50.51 68.04 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.864 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 19.7 p -63.95 -38.02 89.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.92 0.391 . . . . 10.0 110.975 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.72 -26.32 67.98 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.651 -0.704 . . . . 10.0 110.93 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.36 -32.33 10.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.519 -0.31 . . . . 10.0 111.83 179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -62.66 -43.72 98.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.377 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -54.18 -61.93 4.68 Favored Pre-proline 0 CA--C 1.537 0.479 0 CA-C-N 116.387 -0.37 . . . . 10.0 111.568 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.73 -33.56 76.22 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.857 1.705 . . . . 10.0 111.811 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -62.91 -54.78 33.38 Favored 'General case' 0 CA--C 1.521 -0.173 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 31.8 mt -64.75 -41.25 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.315 -0.402 . . . . 10.0 110.679 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -58.96 -54.85 42.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.517 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.83 -39.63 93.87 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.455 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 16.1 mt -60.15 -45.03 94.43 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 123.37 0.419 . . . . 10.0 109.967 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' C' ' 570' ' ' ARG . 56.9 mtt180 -65.07 -43.52 91.92 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -59.77 -35.2 74.15 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.32 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.02 -33.36 12.26 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 121.015 -0.612 . . . . 10.0 112.727 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.559 ' HA ' HG12 ' C' ' 576' ' ' VAL . 9.4 mt -62.53 -42.76 99.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 112.165 0.432 . . . . 10.0 112.165 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.493 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 69.4 mt -51.63 -62.2 3.3 Favored Pre-proline 0 CA--C 1.539 0.522 0 N-CA-C 112.823 0.675 . . . . 10.0 112.823 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 42.5 Cg_endo -68.61 -37.69 12.16 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 121.794 1.663 . . . . 10.0 112.741 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.9 OUTLIER -64.06 -39.23 84.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.944 -0.302 . . . . 10.0 111.324 -179.32 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' C' ' 577' ' ' LEU . 24.2 mt -67.3 -36.88 82.42 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.511 ' O ' HG23 ' C' ' 582' ' ' VAL . 16.7 mm-40 -64.31 -43.25 95.28 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 178.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 24.7 m -61.94 -40.56 95.95 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.821 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -65.04 -44.65 88.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.331 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -57.87 -45.29 86.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.611 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 578' ' ' GLU . 96.2 t -59.78 -45.06 95.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.901 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.5 m -64.88 -42.17 95.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.645 -0.707 . . . . 10.0 110.73 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.2 -43.82 85.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.637 -0.256 . . . . 10.0 111.012 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 34.8 mt -62.14 -46.68 87.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.956 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.6 p -66.23 -31.72 72.71 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.058 0.456 . . . . 10.0 110.589 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.806 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.44 -48.83 59.67 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.981 178.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 60.4 mt -58.63 -46.69 86.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.707 -0.678 . . . . 10.0 111.229 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.61 -47.79 81.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.853 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.0 -39.99 83.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.003 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -61.75 -39.06 90.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.761 0.315 . . . . 10.0 110.701 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 20.1 m -67.59 -22.06 65.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.318 0.58 . . . . 10.0 110.354 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -80.49 -40.27 26.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.134 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.92 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 8.9 mptt -72.2 -39.97 68.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.93 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 63.0 mt -110.34 66.69 0.63 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.444 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.043 -179.93 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' HB ' ' B' ' 50' ' ' THR . 4.4 ptt? . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.812 0.339 . . . . 10.0 111.392 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 131.9 41.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.735 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' B' ' 52' ' ' LEU . 14.7 tt0 -98.21 134.83 40.72 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.461 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -125.76 124.16 40.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.91 0.386 . . . . 10.0 112.037 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm -83.68 106.07 15.1 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.632 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.649 HD11 HD22 ' B' ' 53' ' ' LEU . 11.1 mt -113.57 130.85 56.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.051 0.453 . . . . 10.0 111.626 -178.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 91.5 t -126.83 131.09 71.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.654 HG12 ' HB2' ' B' ' 79' ' ' LEU . 7.2 m -108.17 139.41 30.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.715 -0.221 . . . . 10.0 111.209 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.44 160.04 42.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.391 179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.18 172.69 31.97 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.808 -0.71 . . . . 10.0 111.716 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.72 171.36 15.26 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.458 -0.201 . . . . 10.0 110.458 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.2 127.74 8.48 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.83 -0.7 . . . . 10.0 112.497 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . 0.479 ' HA2' ' HE1' ' B' ' 32' ' ' TYR . . . 104.64 2.05 43.33 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.21 -0.519 . . . . 10.0 112.586 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.412 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 11.3 m -83.02 -18.46 10.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.113 0.412 . . . . 10.0 112.113 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.706 ' HA3' ' H8 ' ' B' ' 216' ' ' GNP . . . 92.96 46.43 3.37 Favored Glycine 0 C--O 1.228 -0.248 0 C-N-CA 120.407 -0.902 . . . . 10.0 111.114 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.564 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 17.4 ttpp -73.28 -50.36 22.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.239 -0.481 . . . . 10.0 111.186 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 67.6 m -69.22 -29.02 66.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.566 -0.288 . . . . 10.0 110.527 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.42 85.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.198 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 84.9 mt -65.45 -42.79 91.98 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.588 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.13 -52.7 61.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.393 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 8.7 mt -62.59 -38.68 82.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 111.768 0.284 . . . . 10.0 111.768 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.497 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 25.4 tp60 -69.44 -24.72 63.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.106 0.41 . . . . 10.0 112.106 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.494 HD13 HG12 ' B' ' 152' ' ' VAL . 15.2 tp -92.99 -40.69 10.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.888 0.375 . . . . 10.0 111.704 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' B' ' 42' ' ' LYS . 37.3 mm -81.84 -67.34 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.107 0.41 . . . . 10.0 112.107 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -80.43 -15.19 57.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.625 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 85.8 m-20 66.47 33.73 6.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.392 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 32.3 t60 -122.8 159.85 27.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.808 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -110.81 149.92 29.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.14 0.495 . . . . 10.0 111.586 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 17.1 m -113.45 156.11 14.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.967 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -131.16 -29.32 1.84 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.582 0.706 . . . . 10.0 109.557 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.484 ' CD ' ' H ' ' B' ' 31' ' ' GLU . 1.5 pm0 -79.33 133.1 36.61 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.157 -0.929 . . . . 10.0 110.738 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.479 ' HE1' ' HA2' ' B' ' 13' ' ' GLY . 47.2 t80 -76.75 89.31 3.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 10.0 109.935 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -109.3 107.81 59.85 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.559 -0.746 . . . . 10.0 110.476 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -66.8 135.58 38.78 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.073 2.515 . . . . 10.0 111.214 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.52 154.03 18.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.78 0.324 . . . . 10.0 111.283 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 44.2 mt -123.07 -54.44 2.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.761 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 33.1 tt0 -145.52 89.97 1.97 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.772 -179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -112.57 135.16 53.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.164 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.34 112.45 18.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.099 0.476 . . . . 10.0 111.928 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -117.91 122.08 42.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.605 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.03 121.94 28.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.666 -179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.426 ' HB2' HD12 ' B' ' 24' ' ' ILE . 31.2 ttpt -129.88 139.59 51.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.466 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -94.96 113.8 25.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.181 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 6.7 m -127.37 -173.09 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.894 0.378 . . . . 10.0 111.217 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 40.1 t -127.83 109.7 20.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.653 -0.499 . . . . 10.0 109.653 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.572 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 50.2 mt -117.54 115.33 48.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.519 0.199 . . . . 10.0 110.94 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.528 ' HB2' HH12 ' B' ' 164' ' ' ARG . 11.7 m-20 65.6 41.15 4.18 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.609 0.596 . . . . 10.0 112.609 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.07 -56.45 2.5 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.938 -0.649 . . . . 10.0 114.417 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -76.25 147.81 38.04 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -67.87 129.77 40.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.426 179.144 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . 0.572 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 36.6 m -121.12 120.19 34.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.186 0.517 . . . . 10.0 111.817 -178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' B' ' 3' ' ' GLU . 1.5 tt -96.4 105.97 18.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.82 -0.808 . . . . 10.0 108.82 179.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.649 HD22 HD11 ' B' ' 6' ' ' LEU . 61.7 mt -88.2 118.62 27.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.206 -0.452 . . . . 10.0 112.1 -178.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -107.77 101.24 10.55 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.731 -0.84 . . . . 10.0 108.731 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 14.0 mt -107.4 128.29 62.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.986 0.422 . . . . 10.0 111.505 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 21.5 tp -112.38 121.66 45.49 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -75.31 160.21 30.58 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.305 0.378 . . . . 10.0 111.024 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 2.7 p -121.99 170.44 9.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.178 0.513 . . . . 10.0 111.328 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -100.23 110.01 22.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.742 -0.663 . . . . 10.0 109.828 178.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.24 -34.82 90.93 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 121.173 -0.537 . . . . 10.0 112.287 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -99.21 76.96 2.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.747 0.308 . . . . 10.0 110.442 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.431 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 28.4 tt0 -157.58 164.14 37.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.958 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -108.15 -157.27 0.61 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.136 -0.484 . . . . 10.0 109.913 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . 0.414 ' HE1' ' NH2' ' B' ' 102' ' ' ARG . 89.7 t80 -72.83 117.54 14.66 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.04 0.447 . . . . 10.0 110.759 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.9 m -123.49 138.29 54.61 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.846 -0.615 . . . . 10.0 110.531 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.49 71.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.069 0.461 . . . . 10.0 110.579 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 56.1 mmm -68.45 -32.72 72.93 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.839 -0.619 . . . . 10.0 110.594 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.616 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.7 ttm180 -66.55 -40.02 88.84 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.32 0.581 . . . . 10.0 109.987 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.79 -31.58 70.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.294 -0.866 . . . . 10.0 110.064 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -63.28 -64.65 0.85 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.239 -0.891 . . . . 10.0 112.483 -179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.616 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.8 p90 -68.7 -24.74 64.52 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.503 0.927 . . . . 10.0 113.503 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 9.0 ttp -71.83 -26.45 62.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.493 0.663 . . . . 10.0 109.696 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -77.05 -23.79 52.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.866 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.4 -11.79 58.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.829 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -83.4 140.85 20.1 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.644 -0.789 . . . . 10.0 112.292 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -105.3 -31.54 9.03 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.773 0.321 . . . . 10.0 110.476 179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.646 ' HA3' HD21 ' B' ' 159' ' ' LEU . . . -112.19 131.77 10.39 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 111.096 -0.801 . . . . 10.0 111.096 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.849 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 91.6 m-85 -120.09 133.14 55.6 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.654 ' HB2' HG12 ' B' ' 8' ' ' VAL . 48.1 mt -121.35 116.01 24.0 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.396 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 7.7 m -93.1 95.21 9.29 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.888 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 22.1 m -97.6 127.94 49.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.046 -0.525 . . . . 10.0 111.704 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.8 p90 -142.54 157.6 44.56 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.191 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.412 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.01 127.96 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.79 HD11 ' HA ' ' B' ' 118' ' ' CYS . 4.0 pt -78.78 7.32 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 112.127 0.417 . . . . 10.0 112.127 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.699 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 1.9 p-10 -97.49 3.81 50.63 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.484 -0.562 . . . . 10.0 109.484 179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.53 HD21 ' HB3' ' B' ' 88' ' ' LYS . 47.3 t30 -140.6 123.69 16.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.546 -0.752 . . . . 10.0 110.99 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -36.09 83.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.749 -0.659 . . . . 10.0 111.214 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.53 ' HB3' HD21 ' B' ' 86' ' ' ASN . 41.9 tttp -57.25 -41.85 80.4 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.435 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 93' ' ' ILE . 3.1 m -62.72 -35.62 80.33 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.608 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -69.56 -33.25 72.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.02 0.438 . . . . 10.0 110.857 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -81.53 -38.16 26.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.228 -0.442 . . . . 10.0 111.066 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.88 -25.07 60.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.775 -0.648 . . . . 10.0 112.466 -179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -59.44 -37.0 67.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.698 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.74 -38.61 85.74 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.211 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -66.27 -47.45 73.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.447 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -67.86 -39.02 83.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.931 -0.577 . . . . 10.0 112.144 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.74 -46.87 83.87 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.063 0.459 . . . . 10.0 110.696 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -70.85 -32.89 70.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.82 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.45 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.7 tt0 -63.14 -49.8 72.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.427 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.2 -39.95 75.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.483 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -56.97 -42.07 79.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.986 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.414 ' NH2' ' HE1' ' B' ' 64' ' ' TYR . 47.0 ttp85 -72.23 -42.14 66.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.118 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.45 HG23 ' O ' ' B' ' 99' ' ' GLN . 66.7 t -63.12 -48.87 85.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.835 -179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -80.41 -7.15 59.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.292 0.479 . . . . 10.0 112.292 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 35.4 t0 56.24 40.38 29.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.771 0.796 . . . . 10.0 110.335 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.5 m -147.58 140.91 25.26 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.187 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -87.0 -15.93 37.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.071 0.463 . . . . 10.0 109.828 179.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -123.81 108.98 13.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.54 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -137.34 157.81 73.44 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.506 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -73.06 103.33 1.58 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.998 2.465 . . . . 10.0 112.128 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.849 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 67.5 mtm -133.77 144.77 49.25 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.601 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.678 HG13 ' HG2' ' B' ' 140' ' ' PRO . 41.2 t -127.54 138.18 55.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.781 -0.452 . . . . 10.0 109.781 179.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' B' ' 141' ' ' PHE . 16.1 tp -96.51 132.55 41.97 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.048 -0.353 . . . . 10.0 110.048 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.613 HG22 ' HB ' ' B' ' 142' ' ' ILE . 2.3 t -132.17 129.06 59.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.058 0.456 . . . . 10.0 111.921 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.22 95.64 1.25 Allowed Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.491 -0.777 . . . . 10.0 111.194 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.527 ' HA ' ' O ' ' B' ' 144' ' ' THR . 65.8 t30 -78.13 163.62 25.7 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.216 0.206 . . . . 10.0 110.925 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.484 ' HB3' HD12 ' B' ' 120' ' ' LEU . 80.0 mttt 63.43 32.75 14.22 Favored 'General case' 0 C--O 1.232 0.156 0 O-C-N 123.757 0.66 . . . . 10.0 110.878 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.79 ' HA ' HD11 ' B' ' 84' ' ' ILE . 0.9 OUTLIER -71.72 -17.02 62.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.459 -0.791 . . . . 10.0 112.192 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -91.93 3.39 55.3 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.565 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.484 HD12 ' HB3' ' B' ' 117' ' ' LYS . 39.0 mt -91.47 140.56 25.45 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.102 178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -68.96 -7.6 21.22 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.754 2.303 . . . . 10.0 112.988 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.699 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -84.01 10.2 10.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.564 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.533 ' HG3' HD12 ' B' ' 84' ' ' ILE . 13.7 ttm-85 -60.14 102.89 0.19 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.887 0.375 . . . . 10.0 111.004 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.88 -37.37 11.76 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.167 0.508 . . . . 10.0 110.414 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 29.4 t -81.03 126.51 39.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.649 -0.5 . . . . 10.0 109.649 179.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -83.32 150.61 26.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.763 0.316 . . . . 10.0 111.022 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 4.7 m -58.55 -37.7 76.27 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.467 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -60.3 -37.89 81.95 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 120.651 0.262 . . . . 10.0 110.96 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -61.2 -45.76 93.26 Favored 'General case' 0 CA--C 1.521 -0.17 0 N-CA-C 109.866 -0.42 . . . . 10.0 109.866 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.1 -39.9 78.71 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.139 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -61.09 -48.15 83.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.239 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -64.0 -39.27 93.74 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.206 0.527 . . . . 10.0 110.544 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 tp -64.01 -53.88 43.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.693 -0.685 . . . . 10.0 110.531 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -59.01 -38.19 78.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.026 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.458 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 15.9 tpt180 -64.9 -34.84 79.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.255 -0.429 . . . . 10.0 111.53 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 21.4 m -69.48 -25.82 64.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -104.54 -1.89 25.95 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.004 0.372 . . . . 10.0 112.004 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 71.09 38.75 63.55 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.98 -0.629 . . . . 10.0 112.587 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.479 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 29.2 pt -126.78 155.47 75.19 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 110.677 -0.12 . . . . 10.0 110.677 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.678 ' HG2' HG13 ' B' ' 112' ' ' VAL . 93.8 Cg_endo -88.08 159.3 7.17 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 122.753 2.302 . . . . 10.0 112.608 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.444 ' HA ' ' O ' ' B' ' 113' ' ' LEU . 52.1 t80 -130.65 131.11 44.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.84 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.613 ' HB ' HG22 ' B' ' 114' ' ' VAL . 15.2 mm -123.21 137.12 57.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-N 116.424 -0.353 . . . . 10.0 110.843 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -92.78 76.73 4.88 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.271 -0.64 . . . . 10.0 109.271 178.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.527 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 3.1 m -84.92 148.99 25.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.574 -0.739 . . . . 10.0 112.345 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.1 t -139.02 124.06 18.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.51 -36.06 52.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.291 0.567 . . . . 10.0 110.107 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.4 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 18.9 tttm -62.55 -45.04 94.79 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.467 -0.788 . . . . 10.0 111.101 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.64 -18.24 30.06 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.131 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.497 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 3.9 ttt-85 64.57 24.0 12.96 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.672 -0.695 . . . . 10.0 111.96 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -98.61 140.02 33.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.931 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 73.53 5.05 66.84 Favored Glycine 0 C--O 1.226 -0.404 0 CA-C-N 116.12 -0.491 . . . . 10.0 113.606 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . 0.494 HG12 HD13 ' B' ' 23' ' ' LEU . 38.4 t -69.58 -62.04 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 111.994 0.368 . . . . 10.0 111.994 -178.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . 0.667 ' HB2' ' H63' ' B' ' 210' ' ' PCW . 1.1 m-20 -53.59 -50.52 65.43 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.34 0.496 . . . . 10.0 112.34 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -59.4 -37.54 78.27 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.723 0.638 . . . . 10.0 112.723 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -56.53 -39.02 72.65 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.47 . . . . 10.0 110.956 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -79.21 -35.3 41.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 10.0 110.504 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.472 ' CD2' ' H61' ' D' ' 503' ' ' PCW . 21.4 m-30 -66.2 -31.55 72.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.246 0.546 . . . . 10.0 110.343 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 93.0 m -61.05 -42.86 99.28 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.532 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.647 HD23 HD22 ' B' ' 6' ' ' LEU . 35.5 tp -62.48 -49.17 76.46 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.948 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.51 -43.6 87.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 121.003 0.43 . . . . 10.0 111.13 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 79.2 mtm180 -61.44 -41.57 97.42 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.457 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.502 ' OE1' ' H61' ' D' ' 507' ' ' PCW . 54.7 mm-40 -71.67 -36.68 70.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.403 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 83.2 mt -63.84 -43.16 97.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 120.92 0.391 . . . . 10.0 110.403 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.528 HH12 ' HB2' ' B' ' 47' ' ' ASP . 83.5 mtt180 -60.6 -46.29 90.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.923 -0.58 . . . . 10.0 110.282 179.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.467 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 24.7 mtmt -69.07 -28.35 66.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.772 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -67.26 -53.33 30.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.044 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -59.91 -37.75 80.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.097 0.475 . . . . 10.0 110.459 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.533 ' OE1' ' H61' ' D' ' 504' ' ' PCW . 28.9 tt0 -69.08 -44.51 72.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.829 -0.623 . . . . 10.0 109.834 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.599 ' HD3' ' H1A' ' A' ' 409' ' ' 17F . 12.0 ttpt -58.94 -33.62 70.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.44 -0.8 . . . . 10.0 111.369 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -56.47 -40.67 75.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.611 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 2.7 m -86.67 -8.61 57.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.051 0.453 . . . . 10.0 111.707 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.661 ' HD2' ' H6A' ' A' ' 409' ' ' 17F . 52.5 mtmt -93.58 -46.98 7.04 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -81.85 -48.2 11.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.811 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 74.73 32.53 57.11 Favored Glycine 0 C--O 1.238 0.387 0 C-N-CA 120.741 -0.742 . . . . 10.0 112.398 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 22.1 tptt 58.35 28.74 17.17 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.291 0.567 . . . . 10.0 111.579 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 24.7 tptp -81.38 -50.9 8.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.726 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? 73.28 -69.86 0.18 Allowed 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.812 0.695 . . . . 10.0 112.178 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -135.83 163.65 29.73 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 10.0 111.126 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -100.71 -89.39 0.34 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.202 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . 0.56 ' HA ' ' HE3' ' B' ' 180' ' ' LYS . 0.5 OUTLIER -135.47 145.45 47.17 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.935 0.397 . . . . 10.0 110.185 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 4.1 m -118.36 141.87 48.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.14 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 18.0 tttm -146.29 139.96 26.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.68 0.276 . . . . 10.0 110.646 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 12.5 t -98.49 174.28 6.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.62 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -69.7 138.74 53.16 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.037 -0.357 . . . . 10.0 110.037 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 65.7 m . . . . . 0 C--O 1.236 0.352 0 O-C-N 123.397 0.436 . . . . 10.0 111.673 -179.888 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.235 0.299 0 CA-C-O 120.659 0.266 . . . . 10.0 110.805 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.23 104.26 7.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.757 0.313 . . . . 10.0 111.508 -178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.9 tp -98.92 113.03 32.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.145 0.498 . . . . 10.0 109.756 178.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -81.69 92.55 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.433 0.635 . . . . 10.0 111.575 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . 0.535 ' HB ' ' O ' ' D' ' 368' ' ' THR . 80.9 t -86.39 111.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.165 -0.925 . . . . 10.0 110.758 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . 0.403 ' O ' ' HA ' ' D' ' 427' ' ' GLN . 28.5 m-85 -104.53 140.09 38.48 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.678 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.623 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 4.3 mp -105.67 167.61 9.47 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.08 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.623 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 13.7 Cg_endo -57.74 154.42 37.55 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.78 2.32 . . . . 10.0 112.053 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' D' ' 436' ' ' LEU . 52.5 t30 74.92 -91.47 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.541 -0.754 . . . . 10.0 111.138 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -162.01 57.6 0.25 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.565 0.58 . . . . 10.0 112.565 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -126.27 150.96 48.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.997 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 9.1 ptt180 -145.8 136.76 24.55 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.916 0.389 . . . . 10.0 111.384 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.535 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 87.0 m -138.25 92.07 2.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.237 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.761 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 24.0 t -81.58 103.52 8.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.185 -0.672 . . . . 10.0 109.185 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.2 m -94.04 174.7 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.366 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -116.07 103.82 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.852 0.358 . . . . 10.0 110.413 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . 0.432 HG11 ' SG ' ' D' ' 381' ' ' CYS . 31.3 m -104.64 162.85 4.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.262 -0.426 . . . . 10.0 110.852 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . 0.475 ' HG3' ' H ' ' D' ' 374' ' ' ASN . 2.4 tpp85 -163.66 -178.5 5.81 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 110.056 -0.35 . . . . 10.0 110.056 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . 0.475 ' H ' ' HG3' ' D' ' 373' ' ' ARG . 79.9 m-20 70.28 -104.54 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.689 0.618 . . . . 10.0 111.428 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -150.57 73.41 0.28 Allowed Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 110.649 -0.98 . . . . 10.0 110.649 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.2 mtt -107.7 142.42 37.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.182 0.515 . . . . 10.0 111.401 -178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 15.1 m -99.15 175.47 5.89 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.882 -0.599 . . . . 10.0 109.45 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.501 HD22 HD22 ' D' ' 426' ' ' LEU . 62.4 mt -55.55 -45.2 77.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.505 0.193 . . . . 10.0 110.932 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' D' ' 382' ' ' LEU . 40.4 t-80 -60.13 -30.97 69.64 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.235 -0.439 . . . . 10.0 111.665 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -64.29 -47.02 81.1 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.407 0.622 . . . . 10.0 110.481 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . 0.432 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.7 m -71.75 -36.59 70.47 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.449 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.858 HD21 HG21 ' D' ' 428' ' ' VAL . 12.4 mt -60.85 -39.31 88.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.439 -0.801 . . . . 10.0 110.974 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 45.6 ttp -60.85 -33.13 72.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.241 -0.436 . . . . 10.0 110.43 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -65.3 -41.87 93.66 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.546 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -80.48 -34.26 35.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.977 -0.556 . . . . 10.0 111.032 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . 0.468 HD21 ' HD3' ' D' ' 393' ' ' PRO . 8.5 tp -54.14 -48.62 70.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.982 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 9.4 ptmt -66.09 -30.98 71.59 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.047 0.388 . . . . 10.0 112.047 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 73.1 t -76.48 -43.0 35.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 121.285 0.564 . . . . 10.0 111.179 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -76.76 -38.61 53.84 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.101 -0.5 . . . . 10.0 111.989 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.36 41.58 20.69 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.798 -0.715 . . . . 10.0 111.967 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 85.7 mt -124.21 170.8 10.38 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -102.81 136.52 19.27 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-O 120.934 0.397 . . . . 10.0 110.932 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . 0.468 ' HD3' HD21 ' D' ' 386' ' ' LEU . 62.1 Cg_endo -74.83 -8.2 20.03 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.66 2.24 . . . . 10.0 112.508 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -64.18 -39.94 95.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 10.0 111.959 -179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . 0.685 ' HA ' ' HB3' ' D' ' 432' ' ' ASP . 64.4 m -85.24 -2.71 58.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.313 -0.403 . . . . 10.0 111.005 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . 0.503 ' HB3' HG12 ' D' ' 428' ' ' VAL . 6.5 m -109.78 163.68 13.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.948 0.404 . . . . 10.0 111.814 -178.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -146.8 144.84 29.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.503 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -87.01 113.68 24.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.018 0.437 . . . . 10.0 111.989 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.434 ' HB3' ' HB3' ' D' ' 409' ' ' LYS . 78.2 m-85 -111.99 127.12 55.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.324 -0.621 . . . . 10.0 109.324 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.523 ' HA ' HD12 ' D' ' 426' ' ' LEU . 10.1 ptm180 -85.03 -173.13 4.56 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.934 0.397 . . . . 10.0 111.2 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . 0.48 HD13 ' HB2' ' D' ' 425' ' ' GLU . 39.5 tp -71.02 143.25 50.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.229 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.25 92.21 0.56 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.956 -0.387 . . . . 10.0 109.956 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -79.9 88.33 5.3 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.162 0.506 . . . . 10.0 110.912 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 53.29 66.26 1.28 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.26 -0.882 . . . . 10.0 110.534 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.44 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 17.2 t-80 -116.53 168.51 10.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.599 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -70.85 -44.16 67.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.066 179.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 165.26 35.79 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.461 -0.876 . . . . 10.0 112.547 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.44 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.4 ttpp -133.66 143.66 48.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.644 0.259 . . . . 10.0 111.11 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.434 ' HB3' ' HB3' ' D' ' 399' ' ' PHE . 23.3 mttt -65.67 149.13 50.61 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.006 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . 0.491 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -101.98 108.62 20.12 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 46.2 ttp180 -67.12 126.46 29.26 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.071 -0.513 . . . . 10.0 111.031 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.463 ' HA ' HD23 ' D' ' 412' ' ' LEU . 4.3 mt -110.67 -179.54 3.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.868 -0.606 . . . . 10.0 111.153 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -91.67 153.32 19.75 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.085 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -71.4 -29.94 65.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.866 0.365 . . . . 10.0 111.469 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -97.19 47.55 1.04 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.437 0.637 . . . . 10.0 111.423 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.463 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 35.3 m -96.27 138.59 33.66 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.33 -0.619 . . . . 10.0 109.33 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -66.56 125.82 26.95 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.073 0.463 . . . . 10.0 111.217 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.12 -29.09 61.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.947 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.86 -34.56 78.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.716 0.294 . . . . 10.0 111.339 -179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 64.2 m -69.99 -17.2 63.27 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.331 0.586 . . . . 10.0 111.14 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -100.3 25.47 7.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.95 -0.568 . . . . 10.0 111.032 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.1 tt -61.98 115.01 1.58 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-O 121.236 0.541 . . . . 10.0 110.762 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 95.73 -8.31 68.34 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.456 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -91.63 151.63 20.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.043 0.449 . . . . 10.0 110.598 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.48 ' HB2' HD13 ' D' ' 401' ' ' LEU . 81.7 mt-10 -101.58 113.76 27.18 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.923 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.523 HD12 ' HA ' ' D' ' 400' ' ' ARG . 5.4 tp -106.93 136.11 47.35 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' D' ' 361' ' ' PHE . 31.6 tt0 -127.65 133.72 49.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.034 0.445 . . . . 10.0 111.216 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.858 HG21 HD21 ' D' ' 382' ' ' LEU . 34.8 t -104.93 100.66 11.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.45 -0.574 . . . . 10.0 109.45 179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -101.31 165.45 11.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.792 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -86.76 127.46 34.99 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.588 -0.278 . . . . 10.0 110.984 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -109.33 -15.64 14.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.08 0.467 . . . . 10.0 110.459 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . 0.685 ' HB3' ' HA ' ' D' ' 395' ' ' CYS . 27.8 t70 -114.02 -6.13 13.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.41 -0.814 . . . . 10.0 109.369 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 -134.53 -177.58 4.67 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.725 -0.67 . . . . 10.0 110.265 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . 0.47 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 7.0 m -98.72 142.16 24.12 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 120.855 0.36 . . . . 10.0 111.38 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 6.2 Cg_exo -76.76 -157.58 0.07 OUTLIER 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.158 2.572 . . . . 10.0 111.893 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . 0.527 ' HA ' ' HB2' ' D' ' 364' ' ' ASN . 1.6 mt 63.95 -173.32 0.17 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.164 0.507 . . . . 10.0 112.165 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 14.8 m -105.48 141.57 36.74 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.599 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.0 145.82 34.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.37 -0.377 . . . . 10.0 110.992 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 36.3 t60 -72.38 98.66 2.27 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.734 -0.839 . . . . 10.0 108.734 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -88.35 122.04 31.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.46 -0.791 . . . . 10.0 111.438 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -72.94 124.91 26.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.725 -0.67 . . . . 10.0 112.016 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -119.25 131.07 55.75 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -104.92 28.83 6.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.857 0.361 . . . . 10.0 111.469 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -74.55 137.17 42.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.178 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 1.3 m -68.98 155.16 40.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.584 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -83.8 162.35 20.64 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.469 . . . . 10.0 111.99 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . 0.543 HD23 ' H52' ' D' ' 506' ' ' PCW . 15.0 mt -113.25 -36.55 4.99 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.268 -0.641 . . . . 10.0 109.268 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . 0.697 ' HD3' ' H51' ' D' ' 503' ' ' PCW . 27.9 tptt -123.96 143.1 50.6 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.351 -0.981 . . . . 10.0 108.351 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 2.4 tp -77.0 77.86 3.55 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.418 0.525 . . . . 10.0 112.418 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -75.79 114.28 14.22 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.44 ' HE1' ' H42' ' D' ' 509' ' ' PCW . 54.3 m-85 -60.16 148.83 34.77 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 112.848 0.684 . . . . 10.0 112.848 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.64 ' HB2' ' HB2' ' D' ' 459' ' ' LEU . 12.6 t -91.78 94.67 9.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.37 -0.832 . . . . 10.0 108.995 179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -77.37 -1.66 31.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.681 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 10.3 mm -83.52 -31.1 8.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.74 -0.837 . . . . 10.0 108.74 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 34.6 m -106.29 -162.68 0.87 Allowed 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.207 -0.906 . . . . 10.0 110.479 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . 0.489 ' O ' ' HD2' ' D' ' 457' ' ' LYS . 2.0 pt20 -115.22 5.1 14.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.837 -0.619 . . . . 10.0 111.816 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' D' ' 456' ' ' GLN . 13.9 mptt -130.82 -178.89 5.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.74 0.305 . . . . 10.0 111.811 -178.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -75.42 160.1 30.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.881 -179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.64 ' HB2' ' HB2' ' D' ' 452' ' ' CYS . 2.0 tm? -108.29 126.77 53.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.645 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.423 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.4 OUTLIER -107.13 -138.5 0.37 Allowed 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.321 -0.399 . . . . 10.0 111.332 179.64 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.423 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.6 p-10 -75.3 57.36 0.88 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.044 0.449 . . . . 10.0 111.274 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -80.3 -145.42 3.95 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.715 -0.675 . . . . 10.0 112.991 -179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -132.8 163.3 29.37 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.963 0.411 . . . . 10.0 110.886 -178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -155.71 150.8 26.62 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.388 -0.968 . . . . 10.0 108.388 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' D' ' 470' ' ' TYR . 0.0 OUTLIER -77.08 162.56 27.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.664 0.268 . . . . 10.0 111.07 179.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -93.36 -39.77 10.75 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 178.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -43.55 23.43 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.516 0.674 . . . . 10.0 109.472 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.14 -172.59 2.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.127 -0.942 . . . . 10.0 109.736 178.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -132.53 36.96 2.1 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.517 -0.849 . . . . 10.0 111.466 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . 0.415 ' HB3' ' SG ' ' D' ' 465' ' ' CYS . 41.0 t80 -78.36 105.95 9.95 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.708 0.289 . . . . 10.0 110.691 -179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 30.3 pttt -84.89 127.43 34.15 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.866 -0.79 . . . . 10.0 108.866 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.963 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.88 158.59 44.28 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.287 0.847 . . . . 10.0 113.287 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -88.28 -168.32 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.162 -0.926 . . . . 10.0 109.423 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . 0.568 ' CD ' ' H42' ' B' ' 206' ' ' PCW . 45.8 mt-10 -82.88 -6.68 59.56 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.197 -0.668 . . . . 10.0 109.197 178.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 23.1 m80 -105.55 -32.11 8.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.343 -0.844 . . . . 10.0 110.314 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.963 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 24.0 m -64.19 -24.03 67.53 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.671 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.42 -57.59 5.15 Favored 'General case' 0 C--N 1.339 0.126 0 O-C-N 123.572 0.545 . . . . 10.0 111.494 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -110.09 46.36 1.03 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 10.0 109.883 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 60.9 tttm -127.98 -47.53 1.37 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.458 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.3 p -82.99 116.65 65.36 Favored Pre-proline 0 C--O 1.235 0.294 0 CA-C-O 121.07 0.462 . . . . 10.0 110.829 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 8.2 Cg_exo -74.99 -24.65 12.65 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.0 2.467 . . . . 10.0 111.275 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.13 94.5 6.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.481 -0.782 . . . . 10.0 110.479 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . 0.582 ' HG3' ' H ' ' D' ' 484' ' ' CYS . 30.0 tpp -75.33 -178.47 4.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.701 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.582 ' H ' ' HG3' ' D' ' 483' ' ' MET . 63.2 m -72.66 55.22 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.093 0.473 . . . . 10.0 112.272 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 16.0 t -112.67 105.08 18.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 109.008 -0.738 . . . . 10.0 109.008 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -133.11 116.85 16.81 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.827 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 7.4 p90 . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.621 179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.022 H472 H271 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 0.816 H241 H461 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.084 H212 H171 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 0.866 ' O11' H152 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.243 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.986 H371 ' H40' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.047 H371 H272 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.076 H121 ' C1Z' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.076 ' C1Z' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.58 ' O2 ' ' H2 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.062 H452 H421 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 1.133 H431 H472 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.109 H422 H231 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 0.939 H261 H182 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.107 H451 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.071 H122 ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 0.994 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.968 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.057 H341 ' H61' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.042 H421 H362 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.136 H482 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 0.866 H231 ' C38' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.05 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.094 H261 ' H62' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.079 H172 H331 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.951 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.097 ' C32' H352 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.109 H231 H422 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 0.979 H251 ' H47' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 1.003 H262 H442 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.079 H331 H172 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.079 ' H39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 0.973 ' H41' ' O31' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.104 H151 H142 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 0.903 H211 H482 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.988 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.043 H141 ' H6 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.054 H162 H152 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.097 H352 ' C32' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.051 ' H19' H151 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.136 H282 H482 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.104 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.04 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.086 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.981 ' C1Y' H172 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 1.094 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.071 ' C9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.0 ' H31' H212 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 0.971 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 0.922 H181 H211 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.032 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 0.823 ' O4P' ' H31' ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.033 H152 H382 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 0.81 ' H42' ' O1 ' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 0.967 ' H2 ' ' H4A' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.001 H231 H472 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.046 ' H42' ' H2 ' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.986 ' H40' H371 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.047 H272 H371 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.127 H121 H371 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.033 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.001 ' H53' H262 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.057 ' H61' H341 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.043 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.706 ' H8 ' ' HA3' ' B' ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 0.997 H261 ' H64' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.082 H412 H352 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.022 H283 H451 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 0.992 H342 ' H6 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.101 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.051 H282 H421 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.135 H431 ' H30' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.274 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.059 H412 H371 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.021 ' H2 ' ' H42' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.067 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.023 ' C12' ' H41' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.135 ' H30' H431 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 0.878 ' H58' ' H2 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.107 H211 H451 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.054 H152 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 86.3 mt . . . . . 0 CA--C 1.519 -0.214 0 CA-C-O 120.649 0.261 . . . . 10.0 110.551 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -56.48 -45.91 80.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 10.0 111.114 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 81.4 mt -70.45 -39.63 74.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.052 -0.522 . . . . 10.0 111.17 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.53 -42.08 78.98 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.011 0.434 . . . . 10.0 111.762 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -68.78 -41.13 79.2 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.345 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.537 HD21 HD21 ' C' ' 569' ' ' LEU . 1.6 m120 -68.78 -30.48 69.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.102 178.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 25.1 t90 -67.17 -36.5 81.93 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -61.36 -31.82 71.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.978 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -67.04 -30.52 70.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.503 0.668 . . . . 10.0 109.638 178.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 41.5 t -79.55 -40.58 21.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.982 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 2.6 m -61.52 -40.07 93.31 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.018 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.5 p -66.22 -44.21 84.47 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.293 -0.632 . . . . 10.0 109.293 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . 0.528 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 59.3 m -62.44 -41.93 99.08 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.38 178.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . 0.447 ' HZ ' H162 ' A' ' 402' ' ' PCW . 0.4 OUTLIER -59.9 -39.69 86.27 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.293 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 18.7 m -68.87 -43.97 74.26 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.129 -0.487 . . . . 10.0 109.697 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 37.0 mmtt -59.59 -46.3 89.34 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.086 -0.506 . . . . 10.0 109.815 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 213' ' ' THR . 67.8 mt -61.98 -46.27 89.98 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.321 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -61.79 -38.72 89.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.49 -0.323 . . . . 10.0 111.472 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.84 -28.5 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 10.0 110.993 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -84.15 -34.64 23.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.266 -0.424 . . . . 10.0 110.638 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 64.3 mt -56.65 -30.86 63.78 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.595 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.68 -69.01 1.4 Allowed Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 111.505 -0.638 . . . . 10.0 111.505 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.01 -38.32 94.89 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.553 2.168 . . . . 10.0 111.692 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 40.6 t -60.39 -50.51 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.504 -0.316 . . . . 10.0 111.444 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.585 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 12.6 p -62.99 -37.75 88.43 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.853 -0.339 . . . . 10.0 110.808 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -66.01 -47.4 74.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.09 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -67.37 -42.26 83.72 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.952 0.406 . . . . 10.0 110.496 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -63.31 -40.88 98.57 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.585 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.6 OUTLIER -62.83 -43.49 98.67 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.597 -0.729 . . . . 10.0 109.759 178.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -61.79 -48.46 80.54 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.119 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.641 ' HA ' ' HE3' ' A' ' 234' ' ' LYS . 31.7 m-80 -60.04 -41.82 93.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.719 -0.475 . . . . 10.0 109.719 179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 46.0 mt -65.92 -36.21 82.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.761 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.78 -40.78 95.81 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 115.889 -0.596 . . . . 10.0 109.442 178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.641 ' HE3' ' HA ' ' A' ' 231' ' ' ASN . 55.1 mtmt -66.33 -36.62 83.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.832 -0.622 . . . . 10.0 109.348 178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.5 -46.98 74.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.511 -0.768 . . . . 10.0 109.288 178.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.551 ' O ' ' HG3' ' A' ' 240' ' ' ARG . 0.7 OUTLIER -67.3 -34.28 77.05 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.377 179.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 240' ' ' ARG . 3.8 tp10 -59.72 -44.77 93.6 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.775 -0.824 . . . . 10.0 108.775 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.68 -45.71 95.72 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 109.627 -1.389 . . . . 10.0 109.627 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.518 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 96.5 mt -64.14 -28.27 69.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.492 -0.354 . . . . 10.0 111.333 179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 236' ' ' THR . 58.3 mtt180 -65.72 -46.99 76.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.283 0.563 . . . . 10.0 109.483 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -72.83 -32.69 65.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.118 -0.946 . . . . 10.0 109.409 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.518 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 3.3 mm-40 -67.99 -32.85 73.54 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.494 -0.776 . . . . 10.0 109.688 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 41.9 ttm -63.2 -30.44 71.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.922 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 13.8 m -74.37 3.73 6.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.659 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -128.94 -59.8 1.11 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.341 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.631 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.9 OUTLIER -53.55 -44.67 69.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.696 -0.684 . . . . 10.0 112.136 -179.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.519 ' O ' HG12 ' A' ' 250' ' ' VAL . 20.9 mt -92.17 -39.61 11.47 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.11 0.411 . . . . 10.0 112.11 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.68 -49.55 68.16 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.262 0.467 . . . . 10.0 112.262 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.54 -35.76 82.03 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.833 -0.347 . . . . 10.0 110.403 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.71 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.0 OUTLIER -70.0 -28.04 34.92 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.181 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.447 ' O ' HG12 ' A' ' 254' ' ' VAL . 89.5 mttt -79.21 -33.06 44.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.096 0.474 . . . . 10.0 110.068 179.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . 0.474 ' HA ' ' NE2' ' A' ' 255' ' ' GLN . . . -74.98 -40.55 60.65 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.628 -0.715 . . . . 10.0 109.276 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 52.8 mttt -77.95 -26.32 48.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.52 -0.764 . . . . 10.0 111.28 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -61.09 -26.77 40.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.83 0.348 . . . . 10.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.534 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 30.3 mt-30 -62.7 -63.22 4.43 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.823 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.534 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 36.7 Cg_endo -68.19 -30.85 30.51 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 121.806 1.671 . . . . 10.0 112.014 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -63.34 -55.51 24.0 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.897 0.379 . . . . 10.0 110.584 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.489 ' HG ' HG22 ' A' ' 254' ' ' VAL . 37.8 mt -66.59 -35.36 80.03 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.642 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -63.0 -46.19 88.83 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.243 -0.435 . . . . 10.0 109.901 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -56.48 -52.76 63.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.518 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.458 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 20.7 m-85 -63.61 -43.14 97.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.445 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -67.11 -39.01 86.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.712 0.292 . . . . 10.0 110.934 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -62.18 -47.37 84.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.563 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.7 mttt -66.35 -41.37 89.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.637 -0.71 . . . . 10.0 109.997 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.485 ' HA ' ' HB2' ' A' ' 268' ' ' GLU . 0.0 OUTLIER -63.17 -34.45 77.65 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.509 179.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -58.39 -49.12 78.39 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 177.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -69.15 -37.5 78.3 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.32 -0.855 . . . . 10.0 110.342 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.485 ' HB2' ' HA ' ' A' ' 265' ' ' TRP . 15.6 mt-10 -59.86 -44.1 94.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.15 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 84.9 mmm -69.08 -42.39 76.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.018 178.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.51 -49.11 79.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.877 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.91 -39.58 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.177 -0.465 . . . . 10.0 109.964 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.419 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.3 OUTLIER -61.42 -44.72 96.64 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.325 -0.398 . . . . 10.0 109.955 178.818 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.41 ' O ' HG12 ' A' ' 276' ' ' VAL . 87.8 mtt180 -70.37 -35.86 73.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.282 0.563 . . . . 10.0 110.575 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -67.01 -26.24 66.68 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 10.0 110.108 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.741 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 12.9 mptt -89.71 -41.59 11.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.243 178.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 280' ' ' ARG . 1.3 p -54.52 -32.83 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 113.296 0.85 . . . . 10.0 113.296 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -66.28 -62.01 4.65 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 112.453 0.538 . . . . 10.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 18.7 Cg_endo -61.86 -37.57 65.56 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.246 1.964 . . . . 10.0 111.636 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 31.8 mt -65.4 -38.9 91.35 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.947 -0.39 . . . . 10.0 109.947 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 52.5 ttt180 -63.83 -35.82 81.88 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.062 -0.718 . . . . 10.0 109.062 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.19 -44.86 82.75 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.599 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.501 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 74.1 mt-10 -61.27 -47.09 87.63 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 178.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 95.8 mt -62.44 -43.57 98.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.928 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -67.19 -50.85 59.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.445 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.47 -42.09 98.24 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.924 -0.399 . . . . 10.0 109.924 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.61 -43.86 97.34 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.484 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.17 -43.41 95.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.637 0.256 . . . . 10.0 110.483 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.589 ' O ' ' HB2' ' A' ' 292' ' ' HIS . 59.1 mtt180 -55.1 -42.75 73.28 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.809 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . 0.406 ' HG2' ' OE2' ' A' ' 293' ' ' GLU . 34.0 tt0 -75.41 -51.32 13.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.739 -179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -58.06 -43.81 87.12 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.459 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 67.0 mt -69.84 -33.04 71.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.624 -0.262 . . . . 10.0 110.768 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 288' ' ' ARG . 1.3 t60 -67.9 -42.65 80.83 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.41 -0.589 . . . . 10.0 109.41 178.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.406 ' OE2' ' HG2' ' A' ' 289' ' ' GLN . 0.4 OUTLIER -61.11 -35.79 77.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.081 -0.711 . . . . 10.0 109.081 178.024 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 23.5 mt -69.3 -38.67 78.41 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.196 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -62.22 -35.76 79.88 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -71.75 -2.56 17.93 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.264 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.596 ' HG3' HD21 ' C' ' 477' ' ' LEU . 8.9 mmtp -111.7 -42.13 3.9 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.509 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 50.8 mt -61.8 -26.63 68.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.459 -0.791 . . . . 10.0 111.434 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.567 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 13.8 m -77.46 -67.41 0.27 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 112.511 0.56 . . . . 10.0 112.511 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.567 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 33.8 Cg_endo -65.25 -53.55 0.81 Allowed 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.853 1.702 . . . . 10.0 112.561 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.599 ' HB3' ' HE3' ' C' ' 473' ' ' LYS . 69.1 mt -67.96 -25.47 65.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.388 . . . . 10.0 110.644 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.509 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -73.07 -49.1 17.53 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.262 -0.735 . . . . 10.0 111.262 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.75 -38.35 83.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.0 0.428 . . . . 10.0 109.863 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.62 -37.39 86.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.388 178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.3 tpt -62.72 -29.57 70.77 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.899 -0.592 . . . . 10.0 109.945 179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.51 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 94.3 mtt180 -73.73 -45.1 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.682 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 35.3 t70 -64.63 -40.76 96.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.2 179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.592 ' HG3' HD21 ' C' ' 469' ' ' LEU . 10.6 mmt180 -68.81 -31.84 71.12 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -70.25 -32.79 70.78 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.78 -0.822 . . . . 10.0 108.78 177.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.682 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 82.6 mtt180 -57.95 -52.77 64.13 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.303 -0.999 . . . . 10.0 108.303 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.51 -34.64 76.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.535 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -57.27 -54.31 48.18 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 123.629 0.581 . . . . 10.0 109.907 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 18.8 t -79.12 -32.32 15.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.916 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.92 -43.92 97.85 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 120.815 0.341 . . . . 10.0 110.136 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -37.64 86.44 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' A' ' 320' ' ' LEU . 24.8 mt -64.44 -50.85 65.92 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.903 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 12.5 mtm105 -59.02 -42.5 90.32 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.035 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.2 m -63.93 -29.28 70.46 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.091 -0.504 . . . . 10.0 111.11 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 24.4 m80 -87.05 -39.82 15.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.175 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 79.6 mt -65.68 -28.52 69.14 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -55.52 -61.82 5.51 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 111.547 0.202 . . . . 10.0 111.547 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 38.2 Cg_endo -68.37 -25.29 36.1 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.392 1.395 . . . . 10.0 111.029 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.522 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 7.0 m-30 -63.63 -57.88 8.68 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.914 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 14.2 p -61.88 -39.52 92.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.71 0.631 . . . . 10.0 110.948 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 0.4 OUTLIER -59.36 -43.28 92.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.99 0.424 . . . . 10.0 110.856 179.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -76.81 -27.94 55.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.332 178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.69 HD23 ' HD2' ' A' ' 330' ' ' ARG . 34.1 mt -66.62 -32.95 74.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.044 -0.725 . . . . 10.0 109.044 177.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 77.0 mtt180 -63.39 -41.19 98.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.408 -0.96 . . . . 10.0 108.408 177.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -69.83 -33.95 73.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.308 -0.86 . . . . 10.0 109.576 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.751 HH21 ' HB3' ' C' ' 447' ' ' GLU . 37.9 mtt180 -66.52 -50.19 64.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.77 178.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -59.38 -41.5 89.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.808 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -62.8 -46.96 85.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.981 178.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -58.64 -45.91 88.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.217 -0.447 . . . . 10.0 109.817 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.437 ' HG2' ' OE1' ' C' ' 440' ' ' GLU . 69.5 mtt180 -62.43 -47.43 84.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.976 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 46.8 mt -59.46 -46.43 88.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.488 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -65.87 -40.02 91.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.794 0.331 . . . . 10.0 111.266 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.84 -44.83 88.49 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.437 -0.579 . . . . 10.0 109.437 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.511 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.5 mt -72.85 -5.42 38.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.924 -0.58 . . . . 10.0 111.185 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -96.63 -55.98 2.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.239 -0.437 . . . . 10.0 109.935 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.43 -47.41 82.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.001 0.429 . . . . 10.0 110.062 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.761 HD21 ' HB3' ' C' ' 432' ' ' LYS . 7.0 t-20 -78.68 -34.16 46.43 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.722 -0.672 . . . . 10.0 109.556 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.511 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -65.37 -43.14 95.5 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.653 -0.703 . . . . 10.0 112.14 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -59.27 -39.22 94.35 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 110.938 -0.865 . . . . 10.0 110.938 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.11 92.53 Favored 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.544 -0.539 . . . . 10.0 109.544 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 86.0 mtt180 -63.89 -43.97 94.43 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.62 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 95.9 mt -60.56 -45.78 92.62 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.276 179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -58.88 -42.93 90.65 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.5 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 19.1 mt-10 -65.32 -42.96 92.45 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.304 178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -56.94 -45.62 82.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.933 0.396 . . . . 10.0 110.057 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 -66.61 -39.48 88.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.773 -0.649 . . . . 10.0 110.721 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.45 -48.38 79.89 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.554 -0.536 . . . . 10.0 109.554 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 26.6 mttm -62.0 -41.24 97.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.788 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.16 -39.28 89.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.211 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 35.0 m -62.31 -44.29 96.84 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 116.001 -0.545 . . . . 10.0 109.892 178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -66.59 -42.01 87.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.921 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 360' ' ' LEU . 23.3 m-70 -62.4 -37.31 85.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.429 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 78.1 mt -69.39 -30.04 67.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 10.0 109.925 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 25.4 m -68.56 -47.0 67.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.927 -0.579 . . . . 10.0 109.715 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.05 -23.2 61.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 10.0 109.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 356' ' ' HIS . 3.1 tt -68.02 -30.79 70.11 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.195 -0.668 . . . . 10.0 109.195 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.1 m -62.46 -32.35 73.22 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 116.245 -0.434 . . . . 10.0 109.901 178.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.52 -27.08 67.48 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.038 -0.528 . . . . 10.0 109.732 179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.783 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 86.5 mttt -88.49 -37.0 16.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.563 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -69.0 -38.11 79.11 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 10.0 112.652 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.792 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 86.4 mttt -106.33 -74.82 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 113.731 1.012 . . . . 10.0 113.731 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.792 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 77.2 Cg_exo -53.99 -55.7 3.23 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.352 2.035 . . . . 10.0 113.46 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.783 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -61.19 -49.88 75.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.685 -0.234 . . . . 10.0 111.599 -179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.03 93.49 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 121.217 -0.193 . . . . 10.0 111.075 179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -62.35 -45.99 90.71 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.09 -0.337 . . . . 10.0 110.09 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.95 -37.79 86.05 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.182 0.515 . . . . 10.0 110.013 179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -43.04 79.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.084 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.6 mtt180 -63.48 -49.67 72.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.976 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -60.95 -32.66 72.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.121 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.51 -29.5 43.9 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.848 -0.691 . . . . 10.0 112.461 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 27.7 mt -76.24 -28.13 57.01 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 111.859 0.318 . . . . 10.0 111.859 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.1 mt -52.01 -58.48 11.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 111.959 0.355 . . . . 10.0 111.959 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -63.36 -30.02 72.61 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 122.189 1.926 . . . . 10.0 111.592 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.35 -50.99 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 N-CA-C 108.519 -0.919 . . . . 10.0 108.519 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 383' ' ' LYS . 92.3 mt -61.58 -37.84 85.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.66 -0.7 . . . . 10.0 110.4 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -61.56 -50.53 72.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.949 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 15.4 m -64.65 -35.8 82.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.763 -0.653 . . . . 10.0 110.568 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -62.28 -43.47 98.75 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.251 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 379' ' ' LEU . 88.8 mttt -58.37 -45.63 87.88 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.529 179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 43.8 t -63.78 -50.66 76.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.029 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.7 p -63.58 -36.5 84.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.681 0.252 . . . . 10.0 111.681 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -69.66 -43.24 72.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.832 0.349 . . . . 10.0 110.479 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 12.7 mt -60.85 -50.04 75.04 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.823 -0.436 . . . . 10.0 109.823 179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.663 ' HB3' ' HE2' ' C' ' 594' ' ' LYS . 45.9 m -61.27 -37.18 82.21 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.856 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -64.89 -44.06 90.85 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.811 -0.44 . . . . 10.0 109.811 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 89.1 mt -59.12 -41.61 88.61 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.869 -0.605 . . . . 10.0 109.839 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -63.9 -42.07 97.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.117 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -58.07 -46.28 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.201 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 397' ' ' LEU . 25.8 m-85 -62.49 -46.93 86.23 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.598 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.1 m -67.7 -21.05 65.34 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.838 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -87.2 -44.52 11.41 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.154 -0.341 . . . . 10.0 111.342 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.718 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.4 mptt -87.75 -45.0 10.73 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.264 0.839 . . . . 10.0 113.264 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 393' ' ' TYR . 90.7 mt -77.69 -13.43 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.889 0.376 . . . . 10.0 111.366 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 53.6 t30 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.966 179.834 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.524 -0.057 0 CA-C-O 121.172 0.51 . . . . 10.0 110.453 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? -105.81 30.62 5.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.464 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' C' ' 405' ' ' TRP . 39.4 mt -59.8 -47.58 85.15 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.537 -0.756 . . . . 10.0 110.895 -179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 33.5 mt -68.34 -29.32 68.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.115 -0.493 . . . . 10.0 111.121 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.73 -49.72 56.57 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.92 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.438 ' O ' HG23 ' C' ' 408' ' ' VAL . 28.4 t-20 -68.8 -29.4 67.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.335 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . 0.461 ' HB2' ' O ' ' C' ' 401' ' ' LEU . 0.0 OUTLIER -67.61 -34.02 76.15 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.917 179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.665 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.85 -39.01 87.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.139 0.495 . . . . 10.0 109.882 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.438 HG23 ' O ' ' C' ' 404' ' ' ASN . 30.7 t -68.18 -41.28 83.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 N-CA-C 109.069 -0.715 . . . . 10.0 109.069 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 26.5 m -62.42 -39.15 92.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.623 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 45.9 m -62.44 -41.44 98.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.298 -0.63 . . . . 10.0 109.298 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.415 HG23 ' HE2' ' A' ' 363' ' ' LYS . 28.3 m -63.08 -42.06 99.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.647 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.42 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 12.1 m-30 -62.95 -39.91 96.07 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.059 -0.519 . . . . 10.0 110.031 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 17.8 m -63.46 -41.12 98.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 10.0 109.83 178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -64.27 -37.69 88.4 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 115.967 -0.56 . . . . 10.0 109.663 178.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . . . . . . . . . 55.9 mt -64.76 -41.43 95.9 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.446 -0.575 . . . . 10.0 109.446 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 86.9 mtt180 -60.88 -35.37 76.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.693 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' C' ' 413' ' ' SER . 55.8 mt-10 -66.4 -44.09 84.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . 0.578 ' O ' ' HB ' ' C' ' 422' ' ' VAL . 38.1 mt-30 -67.3 -33.86 76.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.134 0.492 . . . . 10.0 110.249 179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 82.9 mt -69.45 1.1 4.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.035 -0.53 . . . . 10.0 111.416 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -94.03 -87.93 1.65 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.982 -0.627 . . . . 10.0 111.608 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.509 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 32.3 Cg_exo -59.59 -39.71 72.28 Favored 'Trans proline' 0 C--N 1.34 0.11 0 C-N-CA 123.048 2.498 . . . . 10.0 113.201 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 418' ' ' GLN . 91.2 t -59.72 -40.7 83.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.963 0.357 . . . . 10.0 111.963 -179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 40.3 p -73.16 -33.86 65.72 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.405 -0.518 . . . . 10.0 109.807 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -61.74 -50.3 72.96 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.245 179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 9.2 pt-20 -69.78 -28.6 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -64.71 -40.05 94.71 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.092 -0.707 . . . . 10.0 109.092 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -63.73 -44.08 94.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.222 -0.659 . . . . 10.0 109.222 178.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 17.8 t0 -64.17 -38.56 91.51 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.99 -43.43 95.71 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.855 -0.794 . . . . 10.0 108.855 177.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 48.8 mt -60.73 -37.83 83.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.843 -0.617 . . . . 10.0 109.375 178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.38 -42.23 98.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.761 ' HB3' HD21 ' A' ' 341' ' ' ASN . 43.3 mttp -62.65 -42.55 99.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 345' ' ' ARG . 33.0 mt-10 -63.97 -49.19 73.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.518 179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 1.7 p -64.76 -51.36 62.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.459 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -60.59 -45.29 94.52 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.82 0.343 . . . . 10.0 111.51 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -61.09 -49.48 77.87 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.09 -0.804 . . . . 10.0 111.09 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 27.0 mt -66.64 -26.14 66.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.473 0.178 . . . . 10.0 110.877 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 49.7 mtt180 -68.81 -33.98 74.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.88 -0.415 . . . . 10.0 109.88 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.6 -34.19 76.52 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 177.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.437 ' OE1' ' HG2' ' A' ' 334' ' ' ARG . 33.6 mt-10 -74.59 -50.89 16.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.952 -1.022 . . . . 10.0 109.514 178.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 88.9 mmm -57.76 -42.84 84.81 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.708 -179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -58.37 -49.96 75.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.857 -0.423 . . . . 10.0 109.857 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -65.83 -43.15 89.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.323 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.733 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.9 t0 -57.47 -47.04 82.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.954 -0.567 . . . . 10.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.441 ' O ' HG12 ' C' ' 448' ' ' VAL . 95.9 mt -72.8 -48.73 35.59 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.492 0.552 . . . . 10.0 112.492 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -61.68 -39.5 91.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.877 0.37 . . . . 10.0 111.666 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.751 ' HB3' HH21 ' A' ' 330' ' ' ARG . 25.3 tt0 -80.09 -25.77 39.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.339 -0.391 . . . . 10.0 110.717 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.733 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -67.31 -29.69 46.65 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.165 0 CA-C-O 120.869 0.366 . . . . 10.0 110.026 179.335 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -64.44 -39.77 94.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.28 -0.637 . . . . 10.0 109.28 178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.07 7.04 14.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.955 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 63.5 mttm -118.93 -50.2 2.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.657 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' C' ' 456' ' ' LEU . 91.5 t -62.18 -41.0 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.575 -0.284 . . . . 10.0 111.101 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -56.16 -60.68 8.22 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 112.071 0.397 . . . . 10.0 112.071 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -64.35 -28.74 63.21 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.037 1.825 . . . . 10.0 111.407 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.51 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 9.4 t80 -66.72 -47.6 71.83 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.658 -0.497 . . . . 10.0 109.658 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' C' ' 452' ' ' VAL . 59.6 mt -64.73 -37.86 89.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.224 -0.658 . . . . 10.0 109.224 178.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.13 -51.31 68.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.556 -0.747 . . . . 10.0 110.006 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -64.27 -39.68 94.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.435 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.66 -43.65 96.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.532 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -64.54 -35.27 80.44 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.399 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -66.66 -43.4 84.64 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.535 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.3 OUTLIER -64.69 -44.18 91.14 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.999 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.57 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 45.5 m0 -66.58 -36.75 83.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.3 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -67.02 -39.41 87.03 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 34.5 mt-10 -60.47 -50.03 75.18 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.3 -1.0 . . . . 10.0 108.3 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -56.73 -45.78 81.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.164 -0.926 . . . . 10.0 110.125 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 51.8 ttm -60.77 -48.16 83.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.828 -0.624 . . . . 10.0 110.696 179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . 0.428 ' HA ' ' HD2' ' C' ' 471' ' ' ARG . 5.5 mm-40 -64.18 -36.59 84.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.513 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.592 HD21 ' HG3' ' A' ' 308' ' ' ARG . 81.1 mt -66.01 -43.48 87.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.473 . . . . 10.0 109.819 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.2 m-30 -62.9 -31.81 72.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.59 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' C' ' 468' ' ' GLU . 92.3 mtt180 -67.59 -23.64 65.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.572 179.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.93 11.92 17.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.242 0.544 . . . . 10.0 110.346 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.599 ' HE3' ' HB3' ' A' ' 301' ' ' LEU . 28.1 mttt -131.62 -77.28 0.51 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.58 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' C' ' 478' ' ' ARG . 41.3 t -58.07 -36.69 57.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.387 -0.369 . . . . 10.0 111.306 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.94 -62.94 4.88 Favored Pre-proline 0 CA--C 1.534 0.358 0 N-CA-C 113.047 0.758 . . . . 10.0 113.047 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -65.04 -35.21 43.82 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 121.685 1.59 . . . . 10.0 111.697 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.596 HD21 ' HG3' ' A' ' 297' ' ' LYS . 14.0 mt -67.38 -33.25 74.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.071 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.584 ' HB2' ' O ' ' C' ' 474' ' ' VAL . 10.2 ttt-85 -63.38 -39.4 94.41 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.192 -0.669 . . . . 10.0 109.192 178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.84 86.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.463 -0.789 . . . . 10.0 109.393 178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -66.02 -43.43 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.613 -0.721 . . . . 10.0 110.524 179.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 80.3 mt -62.21 -40.74 97.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.269 178.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -66.83 -36.64 82.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.629 -0.714 . . . . 10.0 109.619 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -64.76 -48.06 75.93 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.833 -0.802 . . . . 10.0 108.833 178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.79 -36.3 92.55 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.507 -1.037 . . . . 10.0 110.507 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.79 -35.47 80.16 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.78 -42.55 90.68 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.233 -0.654 . . . . 10.0 109.233 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 19.8 mm-40 -65.17 -41.27 94.79 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 108.677 -0.86 . . . . 10.0 108.677 177.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -61.49 -41.81 97.83 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.889 -1.05 . . . . 10.0 109.402 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 41.7 mt -64.19 -36.74 85.06 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.507 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -65.59 -47.94 73.99 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.525 -0.917 . . . . 10.0 108.525 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 36.3 mt-10 -58.33 -40.81 83.13 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.625 178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 76.6 mt -67.92 -42.88 80.41 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.505 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.89 -36.68 82.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 10.0 110.16 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -68.31 -7.57 32.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.495 -0.775 . . . . 10.0 110.914 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.741 ' HE3' HD22 ' A' ' 279' ' ' LEU . 54.0 mttp -115.98 -40.72 3.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.36 -0.382 . . . . 10.0 110.852 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.558 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 84.6 mt -62.41 -25.75 68.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.589 -0.278 . . . . 10.0 111.439 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.885 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.7 m -86.44 -66.39 0.19 Allowed Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.595 -0.275 . . . . 10.0 111.471 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.5 Cg_exo -62.34 -58.99 0.29 Allowed 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.074 1.85 . . . . 10.0 112.002 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 11.5 mt -66.38 -31.44 72.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.082 0.468 . . . . 10.0 110.198 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.558 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -62.39 -51.62 55.1 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.588 -0.815 . . . . 10.0 111.083 178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -65.87 -37.68 86.79 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.7 tt0 -61.27 -48.05 83.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.11 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.437 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 86.9 mmm -61.38 -35.54 77.77 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.093 -0.336 . . . . 10.0 110.093 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 48.3 mtt180 -68.04 -41.46 82.03 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.056 -0.52 . . . . 10.0 109.761 179.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.654 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 13.9 t70 -67.86 -36.36 80.16 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.184 -0.462 . . . . 10.0 109.891 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 60.5 mtt180 -60.0 -45.68 91.94 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.21 -37.25 79.71 Favored 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.404 -0.816 . . . . 10.0 110.315 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 87.2 mtt180 -61.29 -47.06 87.69 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.563 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -62.64 -36.65 83.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.091 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.444 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 46.5 m-70 -72.31 -49.97 30.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.518 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 51.1 t -62.48 -42.88 97.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.654 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 22.7 t70 -62.01 -36.71 82.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.197 0.522 . . . . 10.0 109.702 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . 0.464 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -66.89 -45.4 78.14 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.67 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 79.5 mt -59.02 -29.7 67.46 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.692 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.586 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 75.9 mtt180 -61.33 -32.73 72.61 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 121.404 0.621 . . . . 10.0 109.722 178.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 7.96 27.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.872 -0.604 . . . . 10.0 110.954 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.67 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 13.6 m170 -111.23 -63.19 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.63 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.51 -48.29 23.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.891 -0.595 . . . . 10.0 112.247 -178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.646 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.87 -58.21 14.32 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 113.049 0.759 . . . . 10.0 113.049 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 49.0 Cg_exo -60.83 -35.53 88.18 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.885 1.723 . . . . 10.0 111.343 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.458 ' HA ' ' OE1' ' C' ' 524' ' ' GLU . 25.9 t80 -66.3 -35.88 81.51 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.839 -0.43 . . . . 10.0 109.839 179.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 19.8 m -68.7 -31.69 70.95 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -67.25 -42.35 84.1 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 178.16 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.458 ' OE1' ' HA ' ' C' ' 521' ' ' TYR . 42.1 mt-10 -68.01 -35.63 78.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.281 -0.872 . . . . 10.0 108.76 178.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 24.3 mt -66.19 -32.51 73.98 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.687 177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 73.0 mtt180 -62.28 -46.01 90.72 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -63.96 -45.32 89.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.617 179.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.631 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 68.1 mtt180 -60.33 -54.03 50.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.902 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 31.4 mt -59.81 -29.15 68.04 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.573 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -66.88 -28.98 68.76 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.033 -0.358 . . . . 10.0 110.033 178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -90.98 -36.51 14.05 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.565 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 7.9 ttm180 -63.65 -47.17 82.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.632 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.721 HD23 HD12 ' C' ' 536' ' ' LEU . 71.1 mt -70.12 -28.86 65.72 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.62 178.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 32.0 tt0 -62.91 -43.52 98.57 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.581 -0.896 . . . . 10.0 108.581 178.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.65 91.63 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.721 HD12 HD23 ' C' ' 533' ' ' LEU . 69.4 mt -66.13 -32.92 74.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.282 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -76.34 -42.72 43.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.532 -0.304 . . . . 10.0 110.233 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -62.92 -48.77 77.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.95 179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -70.82 -37.11 73.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.887 -0.597 . . . . 10.0 109.481 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -61.31 -48.3 86.14 Favored Glycine 0 C--O 1.223 -0.56 0 CA-C-N 115.766 -0.652 . . . . 10.0 111.703 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.44 -36.74 91.9 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.949 -0.861 . . . . 10.0 110.949 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -69.76 -48.06 60.68 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.908 -0.775 . . . . 10.0 108.908 178.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' C' ' 543' ' ' ARG . 57.0 mtt180 -60.71 -33.95 73.64 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.707 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' C' ' 548' ' ' HIS . 41.2 mt -61.92 -44.74 96.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.442 -0.577 . . . . 10.0 109.442 178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -69.62 -43.78 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.066 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -61.03 -53.96 50.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.585 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -60.89 -34.0 73.97 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.629 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . 0.596 ' HB2' ' O ' ' C' ' 544' ' ' LEU . 0.0 OUTLIER -67.27 -49.77 63.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.93 -0.396 . . . . 10.0 109.93 179.171 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.05 -41.22 96.2 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.593 -0.521 . . . . 10.0 109.593 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.34 -33.79 75.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.168 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -62.98 -42.63 99.89 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.171 -0.677 . . . . 10.0 109.171 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 1.9 m -66.21 -38.91 89.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.489 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.46 -40.08 89.2 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.156 0.503 . . . . 10.0 110.078 178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -69.03 -37.71 78.76 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.88 -43.1 94.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.672 178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.9 p -68.07 -40.48 82.72 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.643 -0.253 . . . . 10.0 111.077 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 2.1 p -68.29 -36.18 78.97 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.961 -0.385 . . . . 10.0 109.961 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' C' ' 558' ' ' LEU . 11.8 mt -62.99 -48.07 80.4 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.137 178.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.4 p -68.43 -39.3 81.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.449 -0.342 . . . . 10.0 110.526 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.82 -33.41 71.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.596 179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.86 ' HA ' ' HE3' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -89.15 -40.8 12.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.846 179.028 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.63 82.52 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.804 0.668 . . . . 10.0 112.804 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -54.6 -64.08 2.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 N-CA-C 112.54 0.57 . . . . 10.0 112.54 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.25 -32.7 41.49 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.786 1.657 . . . . 10.0 112.148 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' C' ' 569' ' ' LEU . . . -63.47 -57.48 10.11 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.549 -0.296 . . . . 10.0 110.491 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 52.9 mt -59.84 -41.75 92.06 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.513 -0.312 . . . . 10.0 110.398 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 2.7 mm-40 -57.79 -52.74 64.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.331 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.54 -38.62 87.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.584 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.537 HD21 HD21 ' A' ' 206' ' ' ASN . 40.9 mt -59.83 -46.22 89.92 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.98 -0.378 . . . . 10.0 109.98 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -68.3 -39.06 82.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.568 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 69.5 mt-30 -63.88 -31.21 72.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.814 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -87.28 -32.65 13.35 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.266 -0.734 . . . . 10.0 111.266 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.573 ' HA ' HG12 ' C' ' 576' ' ' VAL . 16.8 mt -64.72 -41.36 96.02 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.533 -0.333 . . . . 10.0 111.614 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 78.3 mt -52.26 -61.91 3.89 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 112.57 0.581 . . . . 10.0 112.57 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.18 -32.44 20.97 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.085 1.856 . . . . 10.0 112.262 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.573 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -67.56 -39.13 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 120.737 -0.385 . . . . 10.0 110.644 179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.56 -36.64 79.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.538 ' O ' HG23 ' C' ' 582' ' ' VAL . 67.9 mm-40 -65.59 -39.31 91.45 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.264 -0.643 . . . . 10.0 109.264 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 26.7 m -66.69 -38.39 86.67 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.736 -0.666 . . . . 10.0 109.596 178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.34 -32.47 72.6 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.674 178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -63.07 -48.49 78.42 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.538 HG23 ' O ' ' C' ' 578' ' ' GLU . 20.7 t -62.28 -42.85 96.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.989 -0.55 . . . . 10.0 111.118 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 1.7 p -68.86 -40.91 79.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.76 0.314 . . . . 10.0 111.795 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . 0.525 ' O ' ' HG ' ' C' ' 588' ' ' LEU . 3.2 m-85 -70.87 -44.43 66.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.663 -0.244 . . . . 10.0 110.942 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 36.0 mt -57.5 -49.04 77.59 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.196 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.2 p -63.49 -39.25 93.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.854 0.359 . . . . 10.0 110.586 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.718 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -62.19 -51.15 68.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.26 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . 0.801 HD22 ' H48' ' C' ' 630' ' ' 17F . 67.6 mt -61.52 -39.88 92.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.491 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 82.0 mt-10 -62.77 -45.95 90.27 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.369 . . . . 10.0 110.781 179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -68.64 -34.52 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.047 -0.524 . . . . 10.0 111.496 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -59.04 -39.3 81.55 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.046 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 1.4 m -68.45 -30.47 69.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.899 0.381 . . . . 10.0 111.247 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -79.53 -36.35 38.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.8 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.663 ' HE2' ' HB3' ' A' ' 388' ' ' SER . 5.5 mptt -76.43 -46.01 28.93 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.371 179.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 34.8 mt -102.13 54.21 0.8 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.119 0.485 . . . . 10.0 110.063 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 . . . . . 0 C--N 1.319 -0.719 0 CA-C-N 115.908 -0.587 . . . . 10.0 111.57 -179.822 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mmm . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.818 0.342 . . . . 10.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.7 m -76.8 136.7 38.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.292 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -111.86 143.55 42.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.096 0.474 . . . . 10.0 112.032 -178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -125.84 132.83 52.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.025 179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.583 ' HB2' ' HG3' ' B' ' 76' ' ' GLU . 72.1 mmtt -91.79 115.75 28.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.551 -0.295 . . . . 10.0 110.738 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.644 HD22 HD23 ' B' ' 159' ' ' LEU . 36.2 mt -116.46 136.17 53.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.405 -0.361 . . . . 10.0 111.216 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.76 130.91 66.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.759 -0.459 . . . . 10.0 109.759 179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.8 m -104.07 139.52 24.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.12 0.486 . . . . 10.0 111.022 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' B' ' 80' ' ' CYS . 15.2 m -132.54 143.59 39.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.073 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 175.79 176.56 44.12 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.927 -0.654 . . . . 10.0 111.851 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.8 165.31 19.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.803 0.335 . . . . 10.0 110.602 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 109.33 2.76 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.628 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.98 19.8 7.08 Favored Glycine 0 N--CA 1.454 -0.164 0 C-N-CA 120.621 -0.799 . . . . 10.0 112.777 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.451 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 34.2 m -94.47 -14.63 8.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 O-C-N 122.568 -0.372 . . . . 10.0 111.695 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 96.21 29.33 8.52 Favored Glycine 0 CA--C 1.51 -0.248 0 N-CA-C 110.8 -0.92 . . . . 10.0 110.8 -179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.425 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 18.4 ttpp -61.6 -53.13 60.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.995 -0.603 . . . . 10.0 111.442 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -72.77 -31.23 64.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.144 0.497 . . . . 10.0 110.292 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.58 86.85 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.28 -39.84 95.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.445 -0.343 . . . . 10.0 111.052 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.29 -50.41 67.98 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 116.678 -0.237 . . . . 10.0 110.542 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.656 HD13 HG11 ' D' ' 388' ' ' VAL . 7.1 mt -63.97 -38.31 82.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.778 0.323 . . . . 10.0 110.891 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.557 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.4 tp60 -67.69 -21.77 65.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 10.0 112.046 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.469 HD22 HG12 ' B' ' 152' ' ' VAL . 14.0 tp -103.35 -41.71 5.94 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.582 HD13 ' HD3' ' B' ' 42' ' ' LYS . 21.1 mm -74.14 -48.19 38.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 N-CA-C 111.79 0.292 . . . . 10.0 111.79 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -107.26 -7.31 16.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.557 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 7.3 m-80 60.31 44.17 12.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.772 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -132.66 158.48 42.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.205 -0.452 . . . . 10.0 111.175 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -129.14 143.19 50.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.914 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.0 m -111.68 -170.14 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.483 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -139.52 -45.65 0.45 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.955 0.407 . . . . 10.0 111.277 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.31 134.29 42.56 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.222 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.484 ' HE1' HNB3 ' B' ' 216' ' ' GNP . 63.7 t80 -80.76 129.44 34.53 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.165 0.507 . . . . 10.0 111.297 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.15 115.2 8.48 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 115.259 -0.882 . . . . 10.0 108.838 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.25 127.11 23.6 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.15 2.567 . . . . 10.0 112.233 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.661 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 1.9 m -105.07 128.51 53.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.192 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 29.8 mt -97.71 -52.76 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.023 0.439 . . . . 10.0 111.176 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.706 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 16.6 tt0 -138.71 94.11 2.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.914 0.388 . . . . 10.0 111.697 -178.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 31.1 t70 -107.53 119.29 39.02 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 178.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -117.56 101.98 8.81 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.882 0.372 . . . . 10.0 111.431 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.448 ' HB3' HG13 ' B' ' 24' ' ' ILE . 12.0 m-30 -105.25 160.58 14.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.513 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 4.9 ttp180 -149.38 146.17 27.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.073 -0.512 . . . . 10.0 109.673 -178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.582 ' HD3' HD13 ' B' ' 24' ' ' ILE . 10.5 ttpt -153.99 124.46 7.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.953 0.406 . . . . 10.0 111.188 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' D' ' 467' ' ' THR . 0.5 OUTLIER -95.47 104.06 15.95 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . 0.502 ' HB ' HG13 ' B' ' 46' ' ' ILE . 2.4 t -124.02 139.91 49.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.841 0.353 . . . . 10.0 110.579 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' D' ' 464' ' ' ARG . 0.2 OUTLIER -81.13 51.34 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.227 0.536 . . . . 10.0 110.953 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.502 HG13 ' HB ' ' B' ' 44' ' ' VAL . 2.1 mt -72.3 149.79 8.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.116 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.426 ' H ' HD12 ' D' ' 447' ' ' LEU . 0.2 OUTLIER 64.23 12.78 7.41 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.114 0.483 . . . . 10.0 110.964 -179.247 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.75 -39.89 2.62 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 121.026 -0.607 . . . . 10.0 113.482 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.547 ' HA ' ' HE3' ' D' ' 471' ' ' LYS . 31.5 mt-10 -102.51 166.09 10.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.978 0.389 . . . . 10.0 111.812 -178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 57.6 m -66.66 110.16 3.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.666 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 87.4 m -110.54 105.02 13.81 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.74 -0.664 . . . . 10.0 109.736 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.04 112.29 19.65 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.232 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.475 HD22 HD11 ' B' ' 6' ' ' LEU . 59.0 mt -92.85 115.19 27.89 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.921 0.391 . . . . 10.0 111.977 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -108.47 101.02 10.23 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.9 -1.148 . . . . 10.0 107.9 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 9.6 mt -101.82 140.67 19.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.047 0.451 . . . . 10.0 112.214 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.0 tp -126.16 115.89 20.49 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.967 179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.861 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 39.3 t0 -91.39 134.42 34.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.328 -0.396 . . . . 10.0 109.965 179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 18.9 p -101.62 174.91 5.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.233 -0.439 . . . . 10.0 110.952 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.661 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -77.01 117.53 18.69 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 110.082 -0.34 . . . . 10.0 110.082 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.54 -43.44 98.08 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.553 -0.832 . . . . 10.0 111.147 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -101.29 91.37 4.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -148.37 176.52 10.21 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -120.43 -68.08 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.65 0.262 . . . . 10.0 111.496 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -168.46 133.14 1.65 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.658 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 4.8 p -147.21 152.58 38.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.247 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.19 -33.76 76.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.015 179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 99.8 mmm -63.03 -38.78 92.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.675 -0.693 . . . . 10.0 111.031 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -63.17 -42.06 99.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.788 0.328 . . . . 10.0 110.182 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.18 -2.84 29.65 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.496 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -99.52 -67.21 0.86 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.195 -0.457 . . . . 10.0 111.704 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -65.82 -21.52 66.49 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 114.498 1.295 . . . . 10.0 114.498 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.434 ' HE3' HG21 ' B' ' 103' ' ' VAL . 32.8 ttp -76.51 -18.25 58.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.02 0.438 . . . . 10.0 110.994 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 43.9 ttm105 -74.68 -32.26 62.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.478 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.14 -2.51 44.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.444 -0.344 . . . . 10.0 111.841 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.21 152.18 37.74 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.615 -0.803 . . . . 10.0 111.949 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . 0.583 ' HG3' ' HB2' ' B' ' 5' ' ' LYS . 40.2 mt-10 -102.75 -67.63 0.87 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.805 0.336 . . . . 10.0 110.278 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -100.93 134.14 11.58 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.682 -0.77 . . . . 10.0 111.867 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.52 ' O ' ' HA ' ' B' ' 111' ' ' MET . 70.6 m-85 -113.45 126.74 55.67 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.996 0.426 . . . . 10.0 111.847 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.947 ' HG ' HD22 ' B' ' 159' ' ' LEU . 12.5 mt -107.11 111.01 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.448 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.523 ' HB2' HD12 ' B' ' 93' ' ' ILE . 0.6 OUTLIER -88.24 100.41 12.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.2 0.524 . . . . 10.0 109.782 178.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.696 HG12 ' HB ' ' B' ' 114' ' ' VAL . 16.1 m -99.59 131.57 46.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.042 -179.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.6 p90 -142.05 150.41 41.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.079 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.558 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -85.96 123.19 31.01 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.925 HD11 ' HA ' ' B' ' 118' ' ' CYS . 42.1 pt -75.51 -6.91 9.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.744 0.646 . . . . 10.0 112.744 -178.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.558 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 19.1 p-10 -88.12 7.84 29.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.167 0.508 . . . . 10.0 110.08 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.48 ' ND2' ' HB3' ' B' ' 88' ' ' LYS . 51.2 t30 -147.18 111.82 5.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.676 -0.693 . . . . 10.0 109.562 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -22.6 66.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -179.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.48 ' HB3' ' ND2' ' B' ' 86' ' ' ASN . 18.7 tptp -58.06 -43.51 86.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.953 0.406 . . . . 10.0 110.783 179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.504 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.3 OUTLIER -66.16 -33.06 74.91 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.31 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -64.91 -39.14 93.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.738 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.5 mt-10 -77.19 -30.81 54.97 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.189 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -21.42 65.25 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' B' ' 82' ' ' PHE . 28.8 mm -60.28 -42.35 90.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.438 -0.346 . . . . 10.0 110.692 179.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -58.53 -43.06 89.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.227 0.536 . . . . 10.0 110.36 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -62.46 -50.22 72.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.035 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -64.29 -35.9 82.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.151 -0.477 . . . . 10.0 112.043 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' B' ' 97' ' ' ARG . 44.0 ttt-85 -61.92 -51.13 69.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.638 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.3 -33.89 76.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.896 0.379 . . . . 10.0 110.999 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.435 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.0 tt0 -64.71 -49.25 71.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.525 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 98.9 mt -60.33 -44.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.522 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -58.35 -35.45 71.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.029 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 46.8 ttp85 -74.14 -43.25 58.18 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.986 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 99' ' ' GLN . 81.1 t -63.88 -47.79 89.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 CA-C-O 120.931 0.396 . . . . 10.0 111.369 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -77.37 -12.95 60.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.075 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 60.55 29.2 18.84 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 122.002 0.906 . . . . 10.0 110.849 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . 0.473 ' HB2' HG13 ' B' ' 109' ' ' VAL . 3.9 m -130.5 127.15 38.57 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.82 -1.082 . . . . 10.0 109.238 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -73.82 -25.06 59.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.37 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -122.53 106.79 11.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.898 0.38 . . . . 10.0 110.689 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.473 HG13 ' HB2' ' B' ' 106' ' ' SER . 3.6 m -128.63 160.95 60.17 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.008 -0.542 . . . . 10.0 109.805 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . 0.448 ' HD2' ' HB ' ' B' ' 109' ' ' VAL . 56.1 Cg_endo -73.74 98.51 1.06 Allowed 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.103 1.869 . . . . 10.0 111.657 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.52 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 23.7 ttm -131.47 128.63 39.81 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.042 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.618 ' HB ' HD23 ' B' ' 79' ' ' LEU . 60.9 t -115.1 135.96 53.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 30.1 tp -89.06 125.9 35.21 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.342 -0.244 . . . . 10.0 110.342 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.696 ' HB ' HG12 ' B' ' 81' ' ' VAL . 89.8 t -121.76 124.92 72.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.041 0.448 . . . . 10.0 111.305 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.82 105.92 3.08 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.722 -0.951 . . . . 10.0 110.722 179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.526 ' HA ' ' O ' ' B' ' 144' ' ' THR . 53.5 t30 -89.39 165.99 14.01 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.401 0.148 . . . . 10.0 111.401 -178.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 99.2 mttt 61.62 33.0 18.42 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.58 0.55 . . . . 10.0 111.406 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.925 ' HA ' HD11 ' B' ' 84' ' ' ILE . 8.6 p -77.47 -9.51 58.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.769 -0.65 . . . . 10.0 112.562 -179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.01 -12.29 47.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.189 0.519 . . . . 10.0 111.16 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 94.9 mt -81.32 138.26 48.55 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.571 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.24 -8.22 23.02 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.872 2.381 . . . . 10.0 113.098 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -83.43 33.95 0.47 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.664 -179.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.871 ' HG3' HD12 ' B' ' 84' ' ' ILE . 44.1 ttm-85 -65.12 100.48 0.44 Allowed 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.194 0.521 . . . . 10.0 110.229 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.48 -30.35 23.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.216 -179.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 37.3 t -97.59 126.24 50.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.952 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.613 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 1.1 t70 -74.79 146.03 42.42 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.219 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.529 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 0.2 OUTLIER -56.5 -49.01 75.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.949 -179.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -60.46 -33.96 73.32 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 111.691 0.256 . . . . 10.0 111.691 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.613 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 45.8 mt-30 -58.51 -41.45 85.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.786 0.327 . . . . 10.0 110.837 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -80.31 -43.08 21.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.511 . . . . 10.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' B' ' 127' ' ' THR . 57.5 mt-30 -60.5 -40.38 91.18 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.29 0.369 . . . . 10.0 111.916 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.652 ' HA ' ' H63' ' B' ' 209' ' ' PCW . 2.1 t70 -61.96 -47.92 82.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.232 0.539 . . . . 10.0 110.676 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 18.9 tp -64.05 -44.28 92.96 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.558 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . 0.444 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.71 -48.08 82.37 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.204 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.817 ' NH2' ' H2 ' ' B' ' 209' ' ' PCW . 8.9 tpt180 -63.42 -32.01 73.32 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.087 -0.506 . . . . 10.0 111.046 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -67.32 -27.75 67.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.507 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -93.72 -32.45 14.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.973 0.416 . . . . 10.0 110.923 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.13 5.38 32.8 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.614 -0.594 . . . . 10.0 111.614 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.444 ' O ' ' HB1' ' B' ' 134' ' ' ALA . 47.1 pt -100.68 147.7 34.0 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.753 -0.224 . . . . 10.0 110.755 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.459 ' HG2' HG13 ' B' ' 112' ' ' VAL . 83.2 Cg_endo -83.43 152.11 13.61 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.399 2.066 . . . . 10.0 112.988 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -116.15 124.86 51.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.357 -0.608 . . . . 10.0 109.357 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 35.3 mm -122.84 130.6 74.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 O-C-N 123.158 0.286 . . . . 10.0 111.083 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -86.3 139.69 30.76 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.785 -0.82 . . . . 10.0 108.785 177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.526 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 15.7 m -146.81 155.85 42.67 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.798 0.332 . . . . 10.0 110.825 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 6.1 t -142.35 115.81 9.05 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.981 -0.748 . . . . 10.0 108.981 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.417 ' HB3' ' N7 ' ' B' ' 216' ' ' GNP . . . -70.48 -26.49 63.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.378 0.609 . . . . 10.0 109.451 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -67.6 -45.52 75.23 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.992 . . . . 10.0 110.743 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -88.94 -21.61 23.49 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.89 16.22 6.62 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 122.931 0.492 . . . . 10.0 111.769 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -92.98 131.95 37.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.816 0.302 . . . . 10.0 111.816 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 79.38 -2.74 70.24 Favored Glycine 0 C--N 1.332 0.349 0 CA-C-N 116.18 -0.464 . . . . 10.0 113.929 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 23' ' ' LEU . 52.8 t -59.48 -40.48 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.585 0.231 . . . . 10.0 111.386 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -57.36 7.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.582 0.586 . . . . 10.0 112.582 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . 0.466 ' HA ' ' HB2' ' B' ' 157' ' ' TYR . 2.2 t70 -61.01 -28.18 68.85 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.806 0.669 . . . . 10.0 112.806 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.02 -43.16 86.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.169 0.509 . . . . 10.0 109.939 179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -79.7 -33.0 41.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.917 179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.466 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 16.7 m-30 -63.23 -40.44 97.45 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.129 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.568 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 64.1 m -61.72 -34.57 76.04 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.096 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.947 HD22 ' HG ' ' B' ' 79' ' ' LEU . 28.5 tp -65.64 -43.7 88.65 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.266 179.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.06 -39.05 82.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.048 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 69.9 mtt180 -62.36 -39.97 94.89 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.024 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.64 -37.3 84.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.575 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.26 -46.27 92.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.714 0.292 . . . . 10.0 110.867 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 62.5 mtt180 -64.18 -45.26 89.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.843 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -64.41 -40.59 96.09 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.918 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -61.15 -41.7 97.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.243 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -61.29 -44.1 97.77 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.385 -0.37 . . . . 10.0 110.426 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -67.41 -42.62 82.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.062 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.1 ttpt -59.87 -43.06 94.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.084 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 10.6 mmt -64.47 -28.16 69.47 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 10.0 111.339 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 32.4 m -70.52 -19.78 62.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.849 0.357 . . . . 10.0 110.791 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -110.95 11.44 22.22 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.175 0.512 . . . . 10.0 110.608 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -101.04 -69.31 0.78 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.447 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 68.39 23.57 75.04 Favored Glycine 0 C--N 1.331 0.262 0 CA-C-N 116.034 -0.53 . . . . 10.0 113.56 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 67.37 56.32 0.62 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.371 0.605 . . . . 10.0 110.929 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.7 136.27 38.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.606 -0.724 . . . . 10.0 110.229 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -92.08 128.93 38.1 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.01 159.62 30.87 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.03 0.443 . . . . 10.0 111.07 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.461 ' HG3' ' H62' ' A' ' 403' ' ' PCW . 3.2 tptm -133.45 99.18 4.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.784 -0.643 . . . . 10.0 109.73 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -147.25 126.71 13.19 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.594 -179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . 0.714 ' HA ' H372 ' B' ' 209' ' ' PCW . 24.3 m -151.22 136.14 17.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.616 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.435 ' HE3' ' C43' ' B' ' 209' ' ' PCW . 18.6 ptpt -136.51 130.47 32.55 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.824 -0.436 . . . . 10.0 109.824 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . 0.473 HG23 ' H ' ' B' ' 184' ' ' LYS . 0.0 OUTLIER -106.54 -66.95 0.97 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.704 -0.225 . . . . 10.0 111.008 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.473 ' H ' HG23 ' B' ' 183' ' ' THR . 68.0 mmtt 57.63 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 122.91 0.484 . . . . 10.0 112.119 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 63.0 m . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.605 -179.926 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 61.3 t30 . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.668 0.271 . . . . 10.0 110.811 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 86.0 m -148.94 104.23 3.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 10.0 110.665 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 5.0 tp -100.76 111.67 31.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.421 0.629 . . . . 10.0 109.597 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.536 ' HG3' HG22 ' D' ' 369' ' ' VAL . 2.3 ttt180 -89.94 110.32 21.29 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.021 0.439 . . . . 10.0 111.501 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 4.5 t -106.48 126.68 62.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.461 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.54 146.97 27.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.043 0.449 . . . . 10.0 110.615 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.748 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 1.6 mt -108.37 172.41 3.73 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 108.404 -0.962 . . . . 10.0 108.404 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.748 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 18.7 Cg_endo -60.37 159.98 25.2 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.392 2.061 . . . . 10.0 111.461 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . 0.458 ' HB3' ' H ' ' D' ' 365' ' ' LYS . 7.0 t-20 70.02 -98.08 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.855 -0.611 . . . . 10.0 110.602 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' D' ' 364' ' ' ASN . 14.2 ptpt -148.57 10.88 0.86 Allowed 'General case' 0 C--O 1.234 0.27 0 N-CA-C 112.929 0.715 . . . . 10.0 112.929 179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -80.97 149.41 29.35 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.054 -0.35 . . . . 10.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -149.96 148.9 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.75 0.278 . . . . 10.0 111.75 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 45.2 m -146.83 108.4 4.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.131 0.491 . . . . 10.0 111.008 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.706 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 87.7 t -86.35 105.73 14.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.07 174.01 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.777 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -115.23 91.94 3.77 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.817 0.341 . . . . 10.0 110.814 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 23.3 m -77.03 161.48 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.534 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -163.56 160.83 23.52 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.521 -0.309 . . . . 10.0 110.455 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 67.4 -94.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.753 0.658 . . . . 10.0 111.871 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.18 82.97 0.15 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.962 -0.637 . . . . 10.0 111.857 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.13 133.59 52.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.025 0.44 . . . . 10.0 110.19 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 1.6 m -89.97 169.15 11.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.428 HD12 ' O ' ' D' ' 413' ' ' ASP . 30.6 mt -56.16 -35.52 67.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.655 0.264 . . . . 10.0 111.07 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -68.42 -33.91 75.06 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.177 -0.465 . . . . 10.0 111.002 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.92 -53.49 57.83 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.042 0.449 . . . . 10.0 110.892 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 -37.47 85.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.071 0.462 . . . . 10.0 110.172 179.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.656 HD21 HG21 ' D' ' 428' ' ' VAL . 6.9 mt -63.55 -35.72 81.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.611 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.4 ttp -65.13 -33.53 76.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.036 0.446 . . . . 10.0 110.258 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 22.6 mmtp -67.37 -37.55 83.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.408 179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -82.54 -31.01 29.34 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.469 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 27.4 tp -58.59 -40.15 82.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.299 -0.41 . . . . 10.0 111.953 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . 0.461 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 18.2 ptmt -70.22 -24.04 63.03 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.968 -0.293 . . . . 10.0 111.302 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.656 HG11 HD13 ' B' ' 21' ' ' ILE . 68.4 t -81.98 -38.63 15.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.055 0.455 . . . . 10.0 110.258 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' D' ' 389' ' ' ARG . 10.2 mmt180 -81.15 -39.33 25.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.825 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.8 61.64 4.25 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.352 -0.927 . . . . 10.0 111.402 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 41.1 mt -137.51 -172.98 3.36 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.703 -0.248 . . . . 10.0 110.625 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -111.73 124.58 32.1 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.368 -0.378 . . . . 10.0 110.831 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.29 -9.14 24.85 Favored 'Trans proline' 0 N--CA 1.472 0.263 0 C-N-CA 122.942 2.428 . . . . 10.0 112.081 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.35 -37.57 86.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.516 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 85.9 m -94.36 5.76 50.8 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.203 -0.453 . . . . 10.0 112.088 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 7.5 m -103.96 159.32 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.751 0.31 . . . . 10.0 110.806 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . 0.533 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -144.96 139.8 27.78 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.756 178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.1 m -90.84 117.21 33.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.109 0.481 . . . . 10.0 111.158 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.639 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 62.6 m-85 -117.3 131.26 56.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.417 179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -88.2 -172.68 3.9 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.063 -0.347 . . . . 10.0 110.063 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.03 149.59 50.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.736 0.303 . . . . 10.0 110.415 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.4 mp -75.23 82.62 2.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.238 -0.437 . . . . 10.0 110.385 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.53 91.0 0.56 Allowed 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.665 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 56.5 54.76 7.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.478 -0.783 . . . . 10.0 112.292 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -119.09 160.75 21.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.542 -0.299 . . . . 10.0 110.953 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -61.27 -50.53 72.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.964 0.411 . . . . 10.0 111.004 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 174.85 36.69 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.766 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.6 ttpp -125.4 129.53 50.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.785 0.326 . . . . 10.0 110.813 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.639 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 19.5 pttt -66.51 149.34 50.59 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.122 178.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -99.36 110.93 23.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.673 0.273 . . . . 10.0 111.556 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -69.56 134.01 48.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.097 -0.501 . . . . 10.0 111.399 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.47 ' HB3' ' H ' ' D' ' 413' ' ' ASP . 12.5 mt -115.43 -153.95 0.54 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.068 0.461 . . . . 10.0 111.477 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . 0.47 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 8.6 t70 -121.64 160.5 24.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.74 -179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -78.49 -27.77 46.27 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.027 0.441 . . . . 10.0 111.397 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -83.97 -3.39 57.95 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.005 -0.543 . . . . 10.0 112.173 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 15.5 m -59.54 134.8 57.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.879 0.371 . . . . 10.0 110.224 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.2 133.85 47.49 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.919 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.85 -31.97 61.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.419 -0.355 . . . . 10.0 111.584 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -63.11 -28.29 69.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.421 . . . . 10.0 111.244 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 35.5 m -77.08 -11.96 59.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.213 -0.448 . . . . 10.0 111.535 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.16 21.2 17.45 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 10.0 110.982 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 11.3 tt -57.34 129.2 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.7 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.14 -18.65 53.32 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.98 -0.628 . . . . 10.0 113.523 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -93.43 167.03 11.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.348 0.574 . . . . 10.0 111.518 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' D' ' 359' ' ' ARG . 16.1 mt-10 -111.18 121.18 44.63 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.183 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 14.0 tp -100.28 125.51 46.5 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.737 -0.468 . . . . 10.0 109.737 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.73 108.25 19.63 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.233 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.656 HG21 HD21 ' D' ' 382' ' ' LEU . 14.8 t -93.66 85.82 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.526 -0.916 . . . . 10.0 108.526 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -95.05 172.64 8.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.523 -0.762 . . . . 10.0 111.324 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . 0.412 ' HB3' ' HB3' ' D' ' 433' ' ' HIS . 91.3 m-85 -98.58 135.35 40.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.034 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.533 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.7 OUTLIER -115.65 -7.8 12.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.349 0.595 . . . . 10.0 110.367 179.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -139.52 30.23 2.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.454 -0.794 . . . . 10.0 110.411 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . 0.412 ' HB3' ' HB3' ' D' ' 430' ' ' PHE . 33.8 t-80 -147.77 147.74 30.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.274 -179.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 3.0 p -73.88 116.78 55.43 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-O 121.056 0.455 . . . . 10.0 111.444 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' D' ' 436' ' ' LEU . 87.6 Cg_endo -96.86 -176.05 0.28 Allowed 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 123.13 2.553 . . . . 10.0 112.591 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.1 mm? 77.64 149.04 0.1 Allowed 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.42 0.896 . . . . 10.0 113.42 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.54 127.07 32.46 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.261 -0.881 . . . . 10.0 110.624 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.89 167.54 10.09 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.241 -0.652 . . . . 10.0 109.241 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -66.96 142.12 57.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.74 0.305 . . . . 10.0 110.986 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 44.4 t-20 -128.44 111.67 13.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.053 -0.521 . . . . 10.0 110.232 -179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -77.0 121.73 23.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.265 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -146.16 166.6 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.628 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -137.55 130.91 30.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.932 0.396 . . . . 10.0 110.15 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . 0.698 ' HB2' ' HD3' ' D' ' 464' ' ' ARG . 4.1 mmmp? -147.94 160.67 42.56 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.516 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.1 m -78.38 131.11 36.83 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.407 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . 0.538 ' O ' ' H63' ' D' ' 501' ' ' PCW . 5.1 m-85 -76.32 131.41 39.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.796 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . 0.426 HD12 ' H ' ' B' ' 47' ' ' ASP . 95.3 mt -75.17 -44.42 46.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.081 0.467 . . . . 10.0 110.973 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 47' ' ' ASP . 21.4 ttmt -129.26 146.88 51.08 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.332 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.4 tp -65.35 102.3 0.66 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.6 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . 0.497 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -104.13 157.94 16.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.976 -0.75 . . . . 10.0 108.976 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 17.9 m-85 -102.6 157.81 16.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.757 0.313 . . . . 10.0 110.982 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 5.4 t -72.29 138.01 47.1 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.597 -0.89 . . . . 10.0 108.597 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.3 -24.65 27.61 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.419 0.628 . . . . 10.0 109.617 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 34.9 mm -86.35 -37.34 11.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.349 -0.841 . . . . 10.0 109.85 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 6.9 m -106.01 -169.45 1.58 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 111.262 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -119.14 17.01 13.25 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.889 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -109.51 172.21 6.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 10.0 110.227 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . 0.436 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 35.9 p90 -83.89 152.76 24.36 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.132 -0.227 . . . . 10.0 110.562 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.785 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -89.94 108.96 20.03 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.016 0.436 . . . . 10.0 111.0 -179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.45 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -151.12 0.36 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.802 -0.636 . . . . 10.0 110.513 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 3.0 p-10 -78.31 95.37 5.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.376 0.608 . . . . 10.0 111.372 179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -135.23 -109.82 1.05 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.379 -0.828 . . . . 10.0 111.417 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -134.71 137.88 43.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.989 0.423 . . . . 10.0 111.55 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.698 ' HD3' ' HB2' ' D' ' 444' ' ' LYS . 5.7 ptm180 -138.54 134.28 33.68 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.524 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.662 ' HB2' ' H ' ' D' ' 470' ' ' TYR . 27.3 m -64.5 145.71 55.69 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.358 0.599 . . . . 10.0 112.118 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -92.37 -42.69 9.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.396 -0.82 . . . . 10.0 109.63 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' B' ' 43' ' ' GLN . 0.2 OUTLIER -91.52 -46.66 7.85 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.765 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -72.8 -32.79 65.81 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.243 0.544 . . . . 10.0 111.066 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . 0.562 ' N ' ' HB2' ' D' ' 465' ' ' CYS . . . 69.21 37.62 81.47 Favored Glycine 0 N--CA 1.449 -0.483 0 CA-C-N 115.791 -0.641 . . . . 10.0 113.975 179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . 0.662 ' H ' ' HB2' ' D' ' 465' ' ' CYS . 1.0 OUTLIER -106.53 155.99 19.03 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.399 0.599 . . . . 10.0 111.278 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.785 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 13.0 pttp -117.74 133.57 55.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.605 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.814 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 15.9 p90 -154.73 165.34 36.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.29 . . . . 10.0 111.484 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . 0.54 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 55.4 m80 -89.13 -178.29 5.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.681 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -74.47 -15.51 60.89 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.723 -0.671 . . . . 10.0 110.028 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 25.8 m80 -101.58 -13.24 17.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.94 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 20.5 m -85.67 -17.17 36.81 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.467 -0.333 . . . . 10.0 111.642 -179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -46.62 -47.57 19.99 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.167 0.803 . . . . 10.0 113.167 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.44 17.73 18.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.267 0.556 . . . . 10.0 110.161 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.546 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 58.2 tttm -96.54 -43.64 7.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.65 -0.705 . . . . 10.0 111.098 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 2.8 p -72.72 113.51 21.97 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 120.883 0.373 . . . . 10.0 110.875 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.81 -36.98 29.41 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.717 2.278 . . . . 10.0 112.614 -178.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 29.3 m -75.8 114.42 14.38 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.022 0.439 . . . . 10.0 111.349 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 46.3 tpp -72.73 161.94 30.11 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.432 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 31.3 m -70.14 75.06 0.5 Allowed 'General case' 0 C--N 1.324 -0.518 0 O-C-N 123.282 0.364 . . . . 10.0 111.842 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -128.76 107.23 15.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.044 0.45 . . . . 10.0 110.826 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -118.92 129.95 55.46 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.559 -0.534 . . . . 10.0 109.559 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 39.3 p90 . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.832 0.348 . . . . 10.0 111.522 179.657 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.16 H252 H281 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 1.004 H272 H241 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.058 ' C16' H212 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.046 H242 H231 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.209 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.951 H431 ' H19' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.006 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.003 H121 ' H71' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.003 ' H71' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.823 ' C33' H241 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 0.769 ' H11' ' H32' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 0.953 H431 H481 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.12 H431 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 0.954 ' C40' H441 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.102 H362 H412 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.05 H321 ' H52' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.053 H141 H382 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.996 H472 H432 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.084 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.057 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.029 H332 H122 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.005 H442 H483 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.092 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.03 ' H41' H222 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.103 H271 ' H73' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.841 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.017 H172 H351 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.12 ' C17' H431 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.059 H121 H382 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 1.16 H281 H252 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 0.851 ' C22' H272 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.022 H482 H222 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.102 H412 H362 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.062 H422 H282 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.059 H382 H121 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.952 H372 H412 ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.011 H181 H142 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.038 H162 H172 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.128 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 0.983 H412 H412 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.03 H222 ' H41' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.062 H282 H422 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.103 ' H73' H271 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.12 ' H69' ' C8 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.998 ' H33' H141 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 0.869 ' H70' ' H36' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.078 ' H58' ' H65' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 0.877 ' H5 ' ' C19' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.035 ' H75' ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.025 H132 H271 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.052 H161 H322 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.104 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.067 ' H32' H152 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.014 H142 H321 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.087 ' H31' ' H41' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.014 H321 H142 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.067 H152 ' H32' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.817 ' H2 ' ' NH2' ' B' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.121 H262 H252 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.09 H352 ' O31' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 0.99 H242 H432 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 0.907 ' H1 ' ' H12' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 0.994 ' H8A' ' H11' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.12 ' C8 ' ' H69' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.739 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . 0.739 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.057 H483 H232 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.042 H432 ' H20' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.121 H252 H262 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.052 H322 H161 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.042 H222 H181 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.025 H161 H461 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.088 H371 H412 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.137 H382 H232 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.066 ' H51' ' H12' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.113 H181 ' H48' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.051 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.077 ' H65' H371 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.113 ' H48' H181 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 0.853 ' H61' ' H30' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.057 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.038 H172 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.417 ' HA ' HD12 ' A' ' 204' ' ' LEU . 91.3 mt . . . . . 0 N--CA 1.456 -0.134 0 CA-C-O 120.883 0.373 . . . . 10.0 110.62 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 17.7 tttm -60.76 -46.07 91.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.598 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 207' ' ' TRP . 92.4 mt -67.85 -34.05 75.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.398 -0.364 . . . . 10.0 111.244 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 201' ' ' LEU . 47.2 mt -69.06 -41.9 76.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.769 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -67.41 -43.0 82.33 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.299 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -73.4 -22.18 60.3 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.025 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 23.2 t90 -69.58 -28.12 65.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.144 0.497 . . . . 10.0 109.714 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -64.15 -37.63 88.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.024 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -34.24 77.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.212 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 46.5 t -72.63 -47.21 51.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 9.9 m -61.9 -42.52 99.17 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.646 -0.706 . . . . 10.0 111.685 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 34.5 p -63.34 -40.53 97.55 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . 0.468 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 36.0 m -66.47 -46.1 77.5 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -58.25 -39.42 79.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.244 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 14.8 m -65.91 -49.08 69.28 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.459 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -63.15 -35.36 80.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.836 0.35 . . . . 10.0 110.77 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.481 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 76.5 mt -64.92 -41.44 95.55 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 108.98 -0.748 . . . . 10.0 108.98 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -63.43 -37.69 88.26 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.385 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 115.731 -0.668 . . . . 10.0 109.784 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -82.32 -35.52 27.83 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.874 -0.603 . . . . 10.0 109.556 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 42.2 mt -57.07 -39.82 75.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.874 -0.603 . . . . 10.0 111.398 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 226' ' ' GLN . . . -49.86 -67.84 1.65 Allowed Glycine 0 C--N 1.337 0.595 0 O-C-N 123.777 0.673 . . . . 10.0 111.619 179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -55.6 -36.6 94.91 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 122.695 2.264 . . . . 10.0 111.274 177.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 11.0 t -56.66 -48.27 80.99 Favored 'Isoleucine or valine' 0 C--N 1.34 0.186 0 CA-C-N 116.572 -0.285 . . . . 10.0 110.324 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 0.1 OUTLIER -63.89 -35.03 79.32 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 121.064 -0.255 . . . . 10.0 111.074 179.074 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 222' ' ' GLY . 19.4 mt-30 -65.53 -53.36 43.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.818 0.342 . . . . 10.0 110.14 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -62.58 -44.46 96.27 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.662 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -63.74 -46.43 85.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.133 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.642 ' HB2' ' O ' ' A' ' 225' ' ' THR . 0.7 OUTLIER -66.38 -38.34 87.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.303 . . . . 10.0 110.405 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.9 -43.88 97.6 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.869 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 77.2 m-20 -69.22 -36.41 77.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 10.0 109.946 178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 29.7 mt -65.6 -35.86 82.05 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.244 -0.651 . . . . 10.0 109.244 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.03 -35.4 80.44 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.542 178.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.869 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 39.3 mttt -68.84 -40.74 79.26 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.445 -0.946 . . . . 10.0 108.445 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 239' ' ' LEU . 0.1 OUTLIER -63.26 -49.49 73.9 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.264 -0.88 . . . . 10.0 109.676 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 2.0 p -66.11 -34.43 78.04 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.058 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.559 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 33.7 tt0 -61.57 -44.42 97.06 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.835 -0.802 . . . . 10.0 108.835 178.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.61 -42.55 99.68 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.657 -1.377 . . . . 10.0 109.657 178.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 235' ' ' GLU . 99.3 mt -65.8 -31.31 72.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.625 -0.287 . . . . 10.0 110.523 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.559 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 58.4 mtt180 -65.67 -42.78 90.94 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.728 -0.842 . . . . 10.0 108.728 178.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.4 -38.52 77.99 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.13 -23.88 66.57 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.185 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.749 ' HG3' HD12 ' A' ' 247' ' ' LEU . 38.0 ttm -63.47 -31.33 72.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.593 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 14.8 m -81.5 8.09 10.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.614 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 58.1 mttt -131.44 -65.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.036 -0.529 . . . . 10.0 110.419 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.569 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 1.9 t70 -60.16 -25.83 65.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.987 -179.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.749 HD12 ' HG3' ' A' ' 243' ' ' MET . 18.6 mt -108.54 -49.75 3.12 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.854 -0.338 . . . . 10.0 111.493 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.593 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 22.4 mm-40 -56.58 -46.89 80.54 Favored 'General case' 0 C--O 1.238 0.45 0 N-CA-C 112.135 0.421 . . . . 10.0 112.135 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 46.7 mt-10 -65.22 -38.05 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.011 -0.366 . . . . 10.0 110.011 179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.575 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 12.3 t -62.81 -42.79 97.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-N 116.258 -0.428 . . . . 10.0 110.411 178.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -65.49 -21.85 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.934 0.397 . . . . 10.0 111.53 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -91.58 -41.79 10.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.053 0.454 . . . . 10.0 110.506 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -77.13 -27.13 53.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.599 -179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.575 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -59.66 -23.74 26.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.76 0.314 . . . . 10.0 111.258 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.533 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 38.4 mt-30 -65.22 -65.47 1.89 Allowed Pre-proline 0 N--CA 1.451 -0.383 0 CA-C-O 119.102 -0.475 . . . . 10.0 110.895 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.533 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 32.4 Cg_endo -66.41 -30.43 44.32 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.994 1.796 . . . . 10.0 111.837 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.456 ' HA ' ' CE1' ' C' ' 517' ' ' HIS . 4.1 m-30 -63.4 -52.68 60.59 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.006 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.408 ' HG ' HG22 ' A' ' 254' ' ' VAL . 26.3 mt -73.53 -37.49 65.61 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.803 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.75 -37.06 72.96 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.036 0.446 . . . . 10.0 110.0 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.82 -52.9 46.8 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.276 -0.874 . . . . 10.0 109.979 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -62.88 -35.93 81.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.751 -0.659 . . . . 10.0 110.854 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.28 -41.91 89.16 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 8.0 ttmt -64.54 -47.89 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.453 -0.794 . . . . 10.0 108.99 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.603 ' HE3' ' HB1' ' C' ' 509' ' ' ALA . 8.9 mptt -59.37 -45.96 89.97 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.727 -0.67 . . . . 10.0 109.813 178.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.464 ' O ' ' HB2' ' A' ' 269' ' ' MET . 0.1 OUTLIER -56.08 -43.12 77.72 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.479 179.457 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -63.34 -48.76 76.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.308 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 39.6 mt-10 -60.64 -48.5 81.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.136 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 23.6 mt-10 -60.3 -42.44 95.55 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.779 -0.646 . . . . 10.0 110.605 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . 0.464 ' HB2' ' O ' ' A' ' 265' ' ' TRP . 0.0 OUTLIER -66.18 -47.88 72.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.173 179.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.445 ' O ' ' HG3' ' A' ' 274' ' ' GLN . 40.0 mt-10 -58.59 -49.69 76.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.666 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 93.5 mt -57.04 -44.7 83.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.769 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -41.77 94.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.106 -0.497 . . . . 10.0 111.563 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -64.79 -38.02 89.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 10.0 111.103 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 270' ' ' GLU . 46.6 mt-30 -76.46 -25.53 54.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.707 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.7 mptt -91.09 -34.9 14.89 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.595 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . . . . . . . . . 7.5 p -59.71 -31.9 48.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.435 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 1.3 mt-10 -60.45 -61.5 7.82 Favored Pre-proline 0 CA--C 1.534 0.36 0 N-CA-C 112.088 0.403 . . . . 10.0 112.088 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.471 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 20.8 Cg_endo -63.8 -36.37 51.52 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 121.778 1.652 . . . . 10.0 111.77 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 41.0 mt -65.74 -42.11 91.38 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 120.781 0.324 . . . . 10.0 110.611 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -64.46 -35.93 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.032 -0.729 . . . . 10.0 109.032 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.13 -44.78 94.63 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 87.3 mt-10 -64.27 -44.52 91.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.53 -0.759 . . . . 10.0 109.691 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 65.3 mt -63.76 -42.4 97.83 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.374 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -69.46 -55.19 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 10.0 111.56 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -63.21 -38.37 90.92 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.92 0.391 . . . . 10.0 110.21 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . 0.403 ' O ' ' HG3' ' A' ' 290' ' ' LYS . . . -64.89 -40.03 96.96 Favored Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 109.97 -1.252 . . . . 10.0 109.97 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -64.68 -38.05 89.66 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.62 -50.03 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 10.0 109.816 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.17 -42.18 99.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.6 -0.727 . . . . 10.0 110.561 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 286' ' ' GLY . 52.2 mttp -70.06 -32.08 70.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.395 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 28.8 mt -74.8 -39.59 61.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.265 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -59.64 -40.5 87.87 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.779 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.49 -44.05 89.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.75 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 38.6 mt -68.43 -43.33 77.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 10.0 110.467 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -61.49 -36.78 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.008 0.432 . . . . 10.0 110.885 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -65.54 -12.41 52.63 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.989 179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.484 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 8.0 mmtp -108.0 -31.8 7.82 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.861 -0.422 . . . . 10.0 109.861 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.42 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 73.6 mt -62.14 -30.97 71.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.489 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.771 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.0 OUTLIER -78.11 -63.53 0.45 Allowed Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 112.123 0.416 . . . . 10.0 112.123 179.431 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.771 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 18.7 Cg_exo -67.83 -60.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.389 2.059 . . . . 10.0 112.628 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.471 HD13 ' HG2' ' C' ' 473' ' ' LYS . 78.5 mt -62.02 -33.57 74.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 10.0 110.851 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -63.84 -50.37 61.65 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.317 178.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -65.22 -41.11 94.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.909 0.385 . . . . 10.0 110.101 178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -61.1 -38.06 84.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.539 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 12.7 tpt -65.25 -43.99 89.59 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.517 178.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 26.9 mtt180 -63.11 -43.25 98.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.934 -0.575 . . . . 10.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.592 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 19.6 t70 -65.73 -44.81 84.88 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.889 0.376 . . . . 10.0 110.446 179.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.619 ' HG3' HD11 ' C' ' 469' ' ' LEU . 22.2 mmt180 -64.41 -34.79 79.0 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.753 -0.462 . . . . 10.0 109.753 178.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.06 84.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.101 -0.703 . . . . 10.0 109.101 178.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.592 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 74.6 mtt180 -59.44 -46.78 87.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.511 -0.922 . . . . 10.0 108.511 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.16 -38.78 91.64 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.652 -0.704 . . . . 10.0 110.277 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -59.67 -54.31 47.93 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.674 -0.491 . . . . 10.0 109.674 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 65.9 t -65.83 -37.64 80.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.418 -0.81 . . . . 10.0 111.019 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.438 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 0.2 OUTLIER -60.59 -45.11 95.18 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.753 0.311 . . . . 10.0 110.568 179.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.02 -43.3 99.12 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.684 -0.487 . . . . 10.0 109.684 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.09 -42.3 96.97 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.45 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.9 ttm105 -64.65 -44.3 90.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.374 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 22.2 m -62.32 -32.28 73.01 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.97 0.415 . . . . 10.0 110.017 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -79.98 -38.66 31.73 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.133 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 15.9 mt -62.59 -35.55 79.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.176 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.483 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -49.62 -62.91 2.03 Favored Pre-proline 0 N--CA 1.468 0.469 0 N-CA-C 112.953 0.723 . . . . 10.0 112.953 -179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 61.0 Cg_endo -74.38 -31.41 7.34 Favored 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.395 1.396 . . . . 10.0 111.766 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.582 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.6 m-30 -59.83 -55.03 39.21 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.701 -0.227 . . . . 10.0 111.129 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 35.1 p -61.54 -39.06 89.72 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 123.169 0.293 . . . . 10.0 111.254 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.67 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 18.1 t70 -64.34 -43.68 93.88 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 120.854 0.359 . . . . 10.0 110.593 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -69.4 -28.57 66.27 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.864 -0.421 . . . . 10.0 109.864 178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 51.6 mt -67.07 -33.57 75.8 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 108.327 -0.99 . . . . 10.0 108.327 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.67 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.5 mtt180 -65.07 -41.41 95.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 108.365 -0.976 . . . . 10.0 108.365 178.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -64.85 -42.29 95.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.587 -0.733 . . . . 10.0 109.26 178.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.595 HH21 ' HB3' ' C' ' 447' ' ' GLU . 19.3 mtt-85 -61.26 -49.77 75.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.885 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 64.2 mt -60.4 -41.67 94.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 110.583 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.96 -48.73 80.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.563 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.27 -42.24 99.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.223 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -61.25 -51.44 68.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.122 178.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 94.7 mt -61.62 -39.71 92.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.597 -0.728 . . . . 10.0 110.987 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.81 -40.24 94.89 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.85 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.28 -40.54 94.0 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.903 -0.777 . . . . 10.0 108.903 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.55 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 95.7 mt -70.68 -4.11 21.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.015 178.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 31.8 ttmt -106.5 -45.47 4.24 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.325 -0.62 . . . . 10.0 109.325 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -63.6 -53.85 45.19 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.059 -0.719 . . . . 10.0 109.059 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -80.02 -31.61 39.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.678 -0.692 . . . . 10.0 109.44 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.55 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.83 -44.31 98.18 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.321 -0.854 . . . . 10.0 111.875 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.7 -38.85 97.13 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.612 -0.995 . . . . 10.0 110.612 178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.8 92.34 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -65.21 -39.75 93.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.074 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 70.7 mt -66.03 -47.07 75.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.106 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.98 96.92 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.502 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 5.9 mt-10 -65.48 -41.53 93.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.888 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -38.66 91.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.362 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 61.5 m-70 -66.61 -41.19 88.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.199 0.523 . . . . 10.0 109.94 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.96 72.92 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.9 mtmm -59.87 -40.55 89.05 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.354 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.72 -36.36 82.75 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.344 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 40.8 m -65.92 -44.61 84.65 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.364 -0.606 . . . . 10.0 109.364 178.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -61.89 -40.18 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 N-CA-C 108.997 -0.742 . . . . 10.0 108.997 178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -65.61 -42.73 91.25 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.43 -0.804 . . . . 10.0 110.771 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 40.7 mt -63.07 -42.27 99.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 51.0 m -62.34 -40.78 97.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.867 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 4.0 p -78.7 -26.84 44.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.11 0.481 . . . . 10.0 110.332 179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 27.3 tp -67.78 -30.46 69.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 15.3 m -66.65 -28.27 68.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.891 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -68.83 -26.17 65.03 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.675 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 52.0 mttt -88.73 -37.42 15.51 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . 0.461 ' HA ' HD12 ' A' ' 368' ' ' LEU . . . -71.96 -31.09 65.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.458 -0.792 . . . . 10.0 112.754 -178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.884 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 87.5 mttt -105.86 -77.06 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.525 0 N-CA-C 113.563 0.949 . . . . 10.0 113.563 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.884 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -56.61 -49.92 13.34 Favored 'Trans proline' 0 C--N 1.358 1.035 0 C-N-CA 121.966 1.778 . . . . 10.0 113.322 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -66.91 -48.5 68.46 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.41 0.522 . . . . 10.0 112.41 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' A' ' 364' ' ' ALA . 0.4 OUTLIER -62.36 -37.23 84.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.606 0.241 . . . . 10.0 110.627 179.708 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 373' ' ' GLN . 7.7 tt0 -62.77 -42.81 99.86 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.016 -0.735 . . . . 10.0 109.016 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -60.75 -40.82 93.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 368' ' ' LEU . 94.9 mt -63.76 -42.74 97.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.465 -0.789 . . . . 10.0 110.077 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 63.0 mtt180 -64.48 -45.53 86.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.432 -0.349 . . . . 10.0 110.516 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 369' ' ' GLU . 81.9 mt-30 -65.66 -27.77 68.61 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.529 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -81.62 -35.03 23.68 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.414 -0.674 . . . . 10.0 111.414 178.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . 0.418 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 37.0 mt -67.9 -32.09 72.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.537 0.208 . . . . 10.0 111.136 179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 95.8 mt -51.73 -64.21 1.59 Allowed Pre-proline 0 CA--C 1.537 0.473 0 N-CA-C 112.751 0.648 . . . . 10.0 112.751 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.0 -32.29 76.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 122.085 1.857 . . . . 10.0 111.623 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.47 -47.69 90.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.023 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 375' ' ' LEU . 96.1 mt -63.44 -37.35 86.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.405 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.417 ' O ' HG23 ' A' ' 384' ' ' VAL . 3.1 mm-40 -61.41 -52.94 62.49 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.286 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.2 p -66.1 -34.6 78.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.247 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -62.34 -46.05 90.42 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.025 -0.534 . . . . 10.0 110.489 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -58.8 -43.93 90.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.543 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 380' ' ' GLU . 47.3 t -64.32 -44.82 97.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.314 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 16.3 m -62.64 -41.85 99.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.606 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -66.58 -43.6 84.53 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.017 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 63.7 mt -57.76 -48.17 80.4 Favored 'General case' 0 C--O 1.232 0.174 0 O-C-N 123.324 0.39 . . . . 10.0 111.584 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.461 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 1.5 p -67.68 -37.83 82.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.69 -39.24 93.83 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.112 0.482 . . . . 10.0 109.991 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.19 -41.21 98.12 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.683 -0.69 . . . . 10.0 109.246 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.41 -41.73 97.61 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.947 178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 -57.08 -48.52 78.4 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.125 -0.489 . . . . 10.0 111.662 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -62.96 -40.92 99.17 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.211 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -73.36 -27.95 61.78 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -78.81 -33.37 46.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.226 0.454 . . . . 10.0 112.226 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.615 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.8 mptt -97.65 -36.69 10.18 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.587 0.958 . . . . 10.0 113.587 -178.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 81.9 mt -94.13 7.41 45.32 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 120.998 0.427 . . . . 10.0 112.138 -179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 2.2 t30 . . . . . 0 C--N 1.32 -0.693 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.259 179.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.187 0.518 . . . . 10.0 110.335 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.28 23.06 13.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.641 -0.709 . . . . 10.0 110.687 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.07 -44.57 84.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.752 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 55.6 mt -66.9 -26.06 66.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.248 0.547 . . . . 10.0 110.616 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.08 -56.81 9.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.834 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.491 ' O ' HG23 ' C' ' 408' ' ' VAL . 7.9 t-20 -71.77 -25.23 61.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.712 -0.677 . . . . 10.0 111.278 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -66.82 -39.89 87.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.51 -0.314 . . . . 10.0 110.221 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -61.76 -33.32 73.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.054 0.454 . . . . 10.0 109.893 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -34.41 77.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.253 178.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.491 HG23 ' O ' ' C' ' 404' ' ' ASN . 40.1 t -69.13 -46.45 78.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 2.0 m -60.03 -38.07 81.65 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.044 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 47.1 m -64.85 -35.5 81.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.815 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 10.8 m -69.43 -41.76 75.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.406 -0.59 . . . . 10.0 109.406 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.568 ' HD1' HD12 ' C' ' 415' ' ' LEU . 8.6 m-85 -61.89 -37.41 84.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.891 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 32.8 m -66.96 -40.42 87.48 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.526 -0.546 . . . . 10.0 109.526 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 16.7 mmtm -62.56 -31.87 72.74 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 177.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.568 HD12 ' HD1' ' C' ' 412' ' ' PHE . 84.7 mt -68.78 -40.02 79.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.351 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -64.11 -38.01 89.5 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.978 0.418 . . . . 10.0 109.913 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -65.91 -26.11 67.46 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.029 179.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -83.82 -52.57 6.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.762 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.0 mt -47.42 -42.4 22.15 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.429 -0.805 . . . . 10.0 112.439 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.45 -76.68 0.17 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.915 -0.66 . . . . 10.0 112.4 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 52.4 Cg_exo -55.88 -41.01 81.6 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.986 2.457 . . . . 10.0 112.15 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.425 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 24.5 t -57.71 -50.67 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 N-CA-C 111.997 0.369 . . . . 10.0 111.997 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 39.9 p -67.17 -35.3 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.7 -0.4 . . . . 10.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -59.4 -46.31 89.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 10.0 110.375 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.8 pt-20 -80.35 -29.99 37.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.058 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.425 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 12.7 t80 -66.65 -45.45 78.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.419 ' HA ' HD12 ' C' ' 430' ' ' LEU . 6.1 m95 -64.66 -37.82 88.88 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.102 -0.703 . . . . 10.0 109.102 178.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.59 -39.39 91.55 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 108.69 -0.855 . . . . 10.0 108.69 178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.502 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.6 t30 -64.09 -43.67 94.66 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.229 -0.896 . . . . 10.0 108.807 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' C' ' 427' ' ' TRP . 80.4 mt -60.14 -36.72 78.13 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 115.69 -0.687 . . . . 10.0 109.849 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -64.56 -42.29 95.75 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.608 -0.516 . . . . 10.0 109.608 178.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -64.97 -43.33 92.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 40.6 mt-10 -62.02 -53.67 52.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.683 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 3.4 p -57.86 -45.13 86.77 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 116.753 -0.203 . . . . 10.0 111.212 -179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -64.61 -44.0 91.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.602 0.239 . . . . 10.0 110.7 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' C' ' 440' ' ' GLU . . . -62.34 -46.84 93.04 Favored Glycine 0 N--CA 1.451 -0.365 0 N-CA-C 110.785 -0.926 . . . . 10.0 110.785 178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 95.9 mt -63.52 -36.76 84.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.107 0.479 . . . . 10.0 109.853 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -68.01 -31.89 71.89 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.277 178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -68.48 -26.59 65.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.259 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' C' ' 436' ' ' GLY . 30.9 mt-10 -85.08 -46.1 11.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.663 -0.866 . . . . 10.0 108.663 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 94.6 mmm -63.18 -32.86 74.35 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.089 -0.959 . . . . 10.0 112.298 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 7.2 p -59.14 -46.1 89.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.112 0.482 . . . . 10.0 109.988 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -76.43 -40.37 50.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.578 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 5.8 t0 -59.25 -53.65 55.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.577 -179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.99 -46.51 84.26 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.576 0.584 . . . . 10.0 112.576 -179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -64.92 -46.87 79.83 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.737 0.303 . . . . 10.0 111.05 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.595 ' HB3' HH21 ' A' ' 330' ' ' ARG . 7.1 tt0 -69.7 -25.81 64.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.311 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -63.74 -30.49 50.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.049 179.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -66.31 -44.48 83.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -77.93 1.87 19.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.132 -0.94 . . . . 10.0 111.086 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 36.1 mmtm -109.21 -51.24 2.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.068 -0.514 . . . . 10.0 110.04 179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.36 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.44 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -54.24 -61.37 5.57 Favored Pre-proline 0 CA--C 1.537 0.45 0 N-CA-C 112.298 0.481 . . . . 10.0 112.298 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.53 -30.47 35.54 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 121.927 1.751 . . . . 10.0 112.033 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 21.7 t80 -64.38 -45.64 86.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 179.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 21.9 mt -74.46 -32.64 62.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.423 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.85 -50.01 70.54 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.91 -37.03 85.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.22 -0.9 . . . . 10.0 109.935 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -42.81 84.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.582 -0.736 . . . . 10.0 110.242 178.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -59.23 -40.1 84.82 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.982 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 79.8 mttt -63.98 -48.32 76.9 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.664 178.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.492 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.6 OUTLIER -60.85 -42.35 97.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.943 179.515 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 46.7 m0 -65.58 -40.4 92.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.924 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -66.67 -42.72 86.12 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.023 178.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 38.7 mt-10 -56.19 -50.3 71.61 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.295 -0.631 . . . . 10.0 109.295 178.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.68 -39.12 90.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.464 -0.789 . . . . 10.0 110.83 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -63.15 -44.61 95.03 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.847 0.356 . . . . 10.0 110.229 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.32 -41.99 98.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.619 HD11 ' HG3' ' A' ' 308' ' ' ARG . 68.6 mt -65.85 -35.98 82.19 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.486 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 10.2 m-30 -63.27 -31.95 73.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 10.0 110.167 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.666 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 61.5 mtt180 -77.52 -12.68 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.277 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -111.58 1.47 16.86 Favored 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.179 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.62 ' O ' ' HB2' ' C' ' 477' ' ' LEU . 83.0 mttt -128.73 -72.62 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.83 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 45.8 t -56.87 -43.64 80.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.031 -0.532 . . . . 10.0 111.415 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -63.39 -59.42 12.04 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 46.5 Cg_exo -59.79 -41.83 51.23 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 121.752 1.635 . . . . 10.0 110.88 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.62 ' HB2' ' O ' ' C' ' 473' ' ' LYS . 0.0 OUTLIER -63.53 -28.83 70.21 Favored 'General case' 0 C--O 1.223 -0.314 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 0.9 OUTLIER -63.99 -37.02 85.9 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 108.756 -0.831 . . . . 10.0 108.756 178.49 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -73.66 -41.95 62.01 Favored 'General case' 0 C--N 1.328 -0.326 0 O-C-N 123.884 0.74 . . . . 10.0 109.63 179.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -64.77 -39.6 93.88 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.954 178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 50.7 mt -73.87 -28.17 61.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.519 178.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 24.8 tt0 -70.59 -43.08 70.12 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 107.822 -1.177 . . . . 10.0 107.822 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' C' ' 487' ' ' GLN . 2.7 tp10 -63.58 -46.49 85.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.423 -0.955 . . . . 10.0 108.423 178.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.36 93.93 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.866 -0.894 . . . . 10.0 110.866 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.99 -42.49 89.73 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 109.316 -0.624 . . . . 10.0 109.316 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -59.72 -45.32 92.53 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.453 -0.573 . . . . 10.0 109.453 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' C' ' 483' ' ' GLU . 15.7 mm-40 -60.41 -50.07 75.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.327 -0.851 . . . . 10.0 110.002 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -63.53 -36.27 83.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.927 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 34.3 mt -60.59 -47.1 87.71 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 108.601 -0.889 . . . . 10.0 108.601 178.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 65.5 t60 -62.61 -42.58 99.66 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -57.84 -43.3 85.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.631 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 85.8 mt -71.21 -42.97 68.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.928 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . 0.423 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 93.4 mt-30 -59.31 -37.37 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.752 0.311 . . . . 10.0 111.575 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -74.28 -2.73 26.31 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.183 0.516 . . . . 10.0 110.913 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.668 ' HE3' HD22 ' A' ' 279' ' ' LEU . 55.3 mttp -112.46 -49.39 2.96 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 109.641 178.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.519 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 93.2 mt -59.12 -26.93 65.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.84 -0.618 . . . . 10.0 112.346 -179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.883 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 7.7 m -80.21 -65.58 0.27 Allowed Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 120.863 -0.335 . . . . 10.0 111.736 179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.883 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 27.3 Cg_exo -63.48 -50.53 3.34 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 121.932 1.754 . . . . 10.0 111.942 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.621 HD21 ' HG2' ' A' ' 275' ' ' LYS . 47.2 mt -72.13 -23.53 61.32 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.422 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.519 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -70.29 -47.71 42.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 110.172 -1.171 . . . . 10.0 110.172 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -68.28 -33.2 73.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.853 -0.795 . . . . 10.0 108.853 178.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 31.7 tt0 -64.08 -45.53 88.31 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.752 -0.833 . . . . 10.0 108.752 177.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.534 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.6 mmm -62.11 -40.15 94.94 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.466 -0.568 . . . . 10.0 109.466 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 77.0 mtt180 -64.35 -38.33 90.67 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.961 178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.58 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 25.7 t70 -68.33 -41.24 81.06 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.534 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 56.3 mtt180 -58.66 -45.13 90.04 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 107.598 -1.26 . . . . 10.0 107.598 177.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -60.97 -40.51 93.7 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.015 -0.993 . . . . 10.0 110.337 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.58 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 79.1 mtt180 -56.42 -46.26 80.31 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.603 ' HB1' ' HE3' ' A' ' 264' ' ' LYS . . . -65.54 -39.63 91.96 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.257 -0.883 . . . . 10.0 111.189 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.569 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 72.8 m-70 -69.78 -44.52 69.96 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.791 0.329 . . . . 10.0 110.768 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 44.7 t -64.39 -41.78 93.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.246 -0.433 . . . . 10.0 110.014 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' C' ' 515' ' ' ARG . 33.8 t70 -68.2 -33.63 74.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.185 178.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.59 97.31 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 87.9 mt -63.25 -27.9 69.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.47 178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.466 ' O ' ' HB3' ' C' ' 519' ' ' ALA . 72.1 mtt180 -68.79 -27.31 65.76 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.168 -0.469 . . . . 10.0 109.785 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.47 -9.55 20.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.565 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.456 ' CE1' ' HA ' ' A' ' 257' ' ' TYR . 40.8 m170 -107.36 -69.13 0.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.067 0.395 . . . . 10.0 112.067 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.37 -48.51 67.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.545 0.572 . . . . 10.0 112.545 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.69 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -50.21 -59.64 6.71 Favored Pre-proline 0 N--CA 1.469 0.478 0 N-CA-C 113.236 0.828 . . . . 10.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.69 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 36.1 Cg_exo -63.92 -32.11 66.28 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.852 1.701 . . . . 10.0 111.123 179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 12.2 t80 -64.71 -42.34 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.827 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.471 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 0.1 OUTLIER -61.27 -32.43 72.25 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.72 0.295 . . . . 10.0 110.942 178.943 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' C' ' 526' ' ' ARG . 16.9 t0 -72.47 -42.18 65.22 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.124 0.487 . . . . 10.0 109.987 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -66.56 -34.68 78.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.024 -0.732 . . . . 10.0 109.024 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 39.1 mt -65.76 -31.82 73.02 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.399 -0.819 . . . . 10.0 109.822 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' C' ' 522' ' ' SER . 60.8 mtt180 -63.39 -41.74 98.79 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.49 -0.559 . . . . 10.0 109.49 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -65.35 -38.05 88.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.821 -0.627 . . . . 10.0 109.603 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.569 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 83.1 mtt180 -70.73 -43.66 68.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.03 179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 48.0 mt -65.1 -32.1 73.63 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.258 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -62.28 -35.19 78.24 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.687 -0.486 . . . . 10.0 109.687 178.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -80.16 -43.5 21.48 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.534 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -58.21 -47.65 82.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.532 -0.758 . . . . 10.0 110.285 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 92.1 mt -71.18 -34.23 70.71 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.699 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 19.3 tt0 -63.27 -44.73 94.27 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.03 -40.24 95.03 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 49.2 mt -68.09 -29.27 68.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.943 -0.572 . . . . 10.0 110.663 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 23.5 mtmt -77.63 -40.65 41.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.44 -55.81 13.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.569 -0.741 . . . . 10.0 109.96 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.66 -38.09 86.12 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 109.351 -0.611 . . . . 10.0 109.351 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.601 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -62.44 -43.37 99.15 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.402 -0.679 . . . . 10.0 111.402 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.84 -43.06 99.49 Favored Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 110.751 -0.94 . . . . 10.0 110.751 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.08 89.61 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.189 -0.671 . . . . 10.0 109.189 178.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' C' ' 543' ' ' ARG . 52.7 mtt180 -64.28 -33.62 76.25 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.828 179.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 88.4 mt -62.24 -39.79 94.03 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.328 -0.619 . . . . 10.0 109.328 178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.75 -41.91 91.55 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.526 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 32.0 mt-10 -65.23 -42.76 93.08 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.675 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -58.95 -42.18 89.22 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.805 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -70.96 -47.97 56.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.681 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.66 -51.8 68.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.638 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -62.56 -33.72 75.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.478 179.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -68.3 -40.72 81.66 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 109.468 -0.567 . . . . 10.0 109.468 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 21.1 m -64.32 -45.64 87.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.692 -0.686 . . . . 10.0 109.758 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 49.0 mt-10 -67.02 -36.79 82.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.928 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' C' ' 558' ' ' LEU . 3.8 t60 -70.15 -38.41 75.47 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.821 -0.807 . . . . 10.0 108.821 178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 19.9 tp -64.16 -42.37 96.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.932 -0.577 . . . . 10.0 110.513 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 2.3 p -67.29 -44.53 79.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.442 -0.344 . . . . 10.0 110.219 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 9.2 p -68.93 -27.79 66.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.097 0.475 . . . . 10.0 110.736 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' C' ' 554' ' ' HIS . 0.7 OUTLIER -66.74 -60.44 2.69 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.982 -0.747 . . . . 10.0 108.982 178.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.677 ' HB3' ' HE3' ' C' ' 563' ' ' LYS . 38.2 m -61.88 -33.09 73.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.896 179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -55.55 -36.95 67.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.98 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -103.84 -32.67 9.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.192 -0.458 . . . . 10.0 112.115 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -57.05 -44.23 82.79 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.269 0.47 . . . . 10.0 112.269 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.677 ' HE3' ' HB3' ' C' ' 559' ' ' SER . 84.2 mttt -62.53 -59.62 12.26 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 112.405 0.52 . . . . 10.0 112.405 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -61.62 -31.7 86.91 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.709 1.606 . . . . 10.0 111.631 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -66.33 -44.47 83.22 Favored 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 109.693 -0.484 . . . . 10.0 109.693 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 20.6 mt -61.42 -42.68 99.13 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 178.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' C' ' 571' ' ' GLN . 12.3 mm-40 -63.39 -54.54 35.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.723 -0.671 . . . . 10.0 109.935 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -55.68 -45.5 77.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.685 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 40.4 mt -61.75 -44.36 97.05 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 116.074 -0.512 . . . . 10.0 111.189 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -67.17 -38.49 85.51 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.75 0.31 . . . . 10.0 110.643 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' C' ' 567' ' ' GLU . 80.9 mt-30 -69.62 -13.97 62.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 10.0 111.086 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -104.52 -42.58 1.84 Allowed Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.367 -0.693 . . . . 10.0 111.367 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.531 ' HA ' HG12 ' C' ' 576' ' ' VAL . 49.9 mt -66.3 -40.84 90.28 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 111.724 0.268 . . . . 10.0 111.724 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 75.7 mt -56.27 -58.4 16.89 Favored Pre-proline 0 CA--C 1.537 0.444 0 N-CA-C 112.717 0.636 . . . . 10.0 112.717 -179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.35 -39.18 48.56 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 121.971 1.781 . . . . 10.0 112.042 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.531 HG12 ' HA ' ' C' ' 573' ' ' LEU . 1.4 p -68.64 -31.55 51.42 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 CA-C-O 120.574 0.226 . . . . 10.0 111.315 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 20.2 mt -65.48 -38.36 89.53 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.551 -0.537 . . . . 10.0 109.551 178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' C' ' 581' ' ' LYS . 50.6 mm-40 -66.04 -39.05 89.83 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.904 -0.776 . . . . 10.0 108.904 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -66.92 -36.8 83.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.975 -0.75 . . . . 10.0 108.975 177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -64.64 -37.32 87.17 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.373 178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' C' ' 578' ' ' GLU . 93.5 mttt -62.37 -46.39 88.84 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.956 178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 79.1 t -60.17 -39.25 80.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.297 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 10.0 m -71.55 -40.59 69.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.634 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -67.94 -43.77 78.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.858 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 89.4 mt -60.44 -50.91 71.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.218 -0.447 . . . . 10.0 110.617 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 8.1 p -61.55 -30.54 70.72 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.282 0.563 . . . . 10.0 110.655 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.615 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -71.45 -52.91 15.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.066 179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 94.0 mt -56.62 -49.72 74.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.761 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 91.0 mt-10 -57.82 -47.83 81.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.133 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.31 -38.77 81.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.423 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 6.3 m-85 -61.75 -35.1 77.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.771 0.32 . . . . 10.0 110.519 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 17.8 m -66.11 -29.5 69.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.401 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 88.0 mttt -74.55 -42.76 58.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.145 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.461 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.3 mptt -72.16 -46.22 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.191 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . 0.444 HD12 ' H47' ' C' ' 630' ' ' 17F . 61.9 mt -89.29 47.13 1.45 Allowed 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.009 -0.541 . . . . 10.0 111.141 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 . . . . . 0 C--O 1.236 0.381 0 CA-C-N 116.232 -0.44 . . . . 10.0 111.16 179.798 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.3 ptm . . . . . 0 C--O 1.233 0.217 0 CA-C-O 120.462 0.173 . . . . 10.0 110.739 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -86.19 118.67 25.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.013 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 76.1 tt0 -87.42 147.18 25.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.647 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -135.31 125.62 26.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.821 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -89.06 110.99 21.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.893 0.378 . . . . 10.0 110.606 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 28.0 mt -114.01 120.82 41.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.722 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 43.3 t -111.59 119.36 59.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 m -99.28 132.47 44.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 116.443 -0.344 . . . . 10.0 111.674 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 19.3 m -124.29 160.24 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.169 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 172.22 177.7 41.91 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.815 -0.707 . . . . 10.0 111.994 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.29 -174.91 5.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.031 0.443 . . . . 10.0 110.709 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.32 120.49 5.19 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.835 -0.698 . . . . 10.0 112.72 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 88.59 24.07 34.43 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.923 -0.656 . . . . 10.0 113.291 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 19.1 m -86.96 -11.23 11.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 122.613 -0.345 . . . . 10.0 111.476 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.588 ' HA2' ' H8 ' ' B' ' 216' ' ' GNP . . . 85.24 23.49 48.0 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.592 -0.813 . . . . 10.0 111.887 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.459 ' HZ1' ' PG ' ' B' ' 216' ' ' GNP . 22.3 ttpp -61.4 -45.12 95.69 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.742 0.417 . . . . 10.0 111.38 -179.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.86 -41.03 65.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.677 -0.238 . . . . 10.0 110.636 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -46.34 90.48 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.283 -0.417 . . . . 10.0 111.301 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 18.6 mt -54.63 -41.06 69.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.205 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -74.41 -48.18 29.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.987 -0.552 . . . . 10.0 112.44 -179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.591 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.9 mt -62.87 -42.86 98.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.885 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 29.4 tp60 -70.4 -20.4 62.93 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.88 0.372 . . . . 10.0 111.569 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.446 HD13 ' HB ' ' B' ' 152' ' ' VAL . 6.8 tp -90.46 -47.1 7.92 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.038 0.447 . . . . 10.0 111.666 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.832 HG23 ' HD3' ' B' ' 42' ' ' LYS . 38.9 mm -79.83 -59.36 2.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.599 -0.728 . . . . 10.0 112.514 -178.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -89.1 -9.03 52.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.896 0.332 . . . . 10.0 111.896 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.93 31.68 13.66 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 122.963 0.505 . . . . 10.0 111.988 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -121.55 138.61 54.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.864 0.364 . . . . 10.0 110.637 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . 0.486 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 4.9 t80 -109.86 150.06 28.95 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.076 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 5.5 m -104.43 -179.71 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.199 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -133.49 -35.04 1.02 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.463 0.649 . . . . 10.0 109.556 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -97.42 156.0 16.67 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.978 -1.01 . . . . 10.0 110.061 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -98.48 123.77 42.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.666 0.269 . . . . 10.0 110.683 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -133.69 111.54 12.48 Favored Pre-proline 0 C--N 1.324 -0.505 0 N-CA-C 109.939 -0.393 . . . . 10.0 109.939 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.81 133.07 55.84 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.124 2.55 . . . . 10.0 111.906 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.15 117.46 29.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.508 -0.315 . . . . 10.0 111.401 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.804 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 51.0 mt -79.11 -49.13 20.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.827 0.346 . . . . 10.0 110.276 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.871 ' HB3' HG23 ' D' ' 369' ' ' VAL . 37.0 tt0 -145.55 121.05 10.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.979 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -143.99 128.16 17.66 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.782 -0.821 . . . . 10.0 108.782 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -103.0 132.16 49.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.441 0.534 . . . . 10.0 112.441 -178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.799 ' HE1' ' HB2' ' B' ' 57' ' ' ASP . 21.1 m-85 -125.24 96.5 4.86 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 10.0 109.989 178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -115.05 127.26 55.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.61 -0.268 . . . . 10.0 110.748 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.832 ' HD3' HG23 ' B' ' 24' ' ' ILE . 9.8 ttpt -141.73 162.48 35.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.733 -0.212 . . . . 10.0 110.821 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' HA ' ' D' ' 468' ' ' CYS . 1.5 mp0 -105.44 110.52 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.589 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . 0.489 HG12 ' NH2' ' D' ' 464' ' ' ARG . 0.6 OUTLIER -125.16 168.86 17.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.471 -0.332 . . . . 10.0 110.679 179.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' HD12 ' D' ' 447' ' ' LEU . 42.1 t -116.75 99.46 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.713 0.292 . . . . 10.0 110.911 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 22.4 mt -104.2 124.14 58.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.496 -0.32 . . . . 10.0 111.352 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.695 ' HA ' ' HD3' ' D' ' 448' ' ' LYS . 7.6 m-20 74.25 -16.64 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.74 1.015 . . . . 10.0 113.74 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.729 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . 136.35 -22.75 3.35 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.455 -0.879 . . . . 10.0 111.861 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -104.73 143.46 33.08 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.13 -0.322 . . . . 10.0 110.13 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.46 128.14 34.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.205 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 56.7 m -119.65 130.07 54.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.127 0.489 . . . . 10.0 111.174 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 27.3 tp -96.08 91.33 5.9 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.403 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.4 mt -80.32 108.86 14.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.029 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -105.64 99.08 8.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.24 -0.652 . . . . 10.0 109.24 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.44 ' HB ' ' HB2' ' B' ' 40' ' ' TYR . 9.9 mt -94.07 129.61 44.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.777 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 35.2 tp -115.11 117.79 31.55 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.146 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB2' ' HE1' ' B' ' 40' ' ' TYR . 25.4 t0 -84.72 137.36 33.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.725 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -111.73 163.26 14.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.281 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.804 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -77.78 124.5 28.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.742 0.306 . . . . 10.0 110.88 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.34 -25.09 55.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.629 -0.796 . . . . 10.0 111.34 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -102.13 50.9 0.83 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 10.0 111.129 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.442 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 61.0 tt0 -139.46 142.02 37.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -83.67 -151.49 0.12 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.881 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -69.33 126.39 29.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.96 0.409 . . . . 10.0 111.405 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.5 m -135.06 129.02 33.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.852 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.79 72.99 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.625 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 98.3 mmm -70.38 -26.14 63.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.671 0.272 . . . . 10.0 111.325 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.446 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.2 ttm180 -67.33 -46.0 74.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 10.0 110.145 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -55.29 -35.93 65.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.36 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 -59.16 -65.16 0.71 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.377 -0.829 . . . . 10.0 112.718 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.446 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 11.0 p90 -72.7 -28.68 62.83 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 114.206 1.187 . . . . 10.0 114.206 -177.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 25.7 ttp -70.71 -26.27 63.33 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.899 0.38 . . . . 10.0 111.431 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 73' ' ' ARG . 35.4 ttm105 -72.44 -24.88 61.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.835 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 6.5 m -79.92 -16.07 56.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.098 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.09 139.78 31.58 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.867 -0.683 . . . . 10.0 112.168 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -99.35 -31.68 11.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.754 0.312 . . . . 10.0 111.155 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -126.8 144.05 14.78 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.845 -0.693 . . . . 10.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.813 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 66.3 m-85 -128.43 141.1 51.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.361 . . . . 10.0 110.713 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' B' ' 112' ' ' VAL . 50.0 mt -121.34 110.6 16.31 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.183 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.565 ' HB2' HD12 ' B' ' 113' ' ' LEU . 1.7 m -78.79 82.6 4.99 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.715 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.54 HG12 ' HB ' ' B' ' 114' ' ' VAL . 6.0 m -88.65 118.5 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.737 -0.665 . . . . 10.0 111.621 -179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' B' ' 93' ' ' ILE . 19.1 p90 -135.14 154.11 51.76 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.292 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.404 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -88.07 122.44 31.66 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.01 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.765 HD11 ' HA ' ' B' ' 118' ' ' CYS . 22.9 pt -78.11 4.51 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 113.157 0.799 . . . . 10.0 113.157 -178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.404 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.1 p-10 -91.1 -1.49 57.75 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.911 -0.403 . . . . 10.0 109.911 179.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -138.74 144.69 39.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.543 -0.753 . . . . 10.0 109.948 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.94 -35.88 37.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.113 -0.494 . . . . 10.0 112.015 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -57.01 -40.64 77.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.219 -0.446 . . . . 10.0 112.065 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.448 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.0 -32.93 68.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.925 -179.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -75.95 -39.71 55.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.735 0.303 . . . . 10.0 111.362 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -73.25 -28.91 62.41 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.889 0.376 . . . . 10.0 111.375 -179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -20.23 61.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.492 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.696 HD11 ' HB3' ' B' ' 82' ' ' PHE . 27.3 mm -60.16 -44.92 96.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.842 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.453 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 17.0 t60 -62.5 -37.31 85.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.942 0.401 . . . . 10.0 110.554 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -61.48 -48.78 79.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.204 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -66.12 -34.09 77.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.155 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 19.6 ttt180 -61.08 -50.69 72.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.318 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 57.7 mm-40 -63.44 -31.4 72.55 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.581 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.518 ' O ' HG23 ' B' ' 103' ' ' VAL . 35.1 tt0 -67.34 -49.9 62.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.844 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.52 -40.39 84.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.829 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -56.7 -36.16 69.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.689 179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 47.8 ttp85 -75.27 -42.66 54.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.67 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.518 HG23 ' O ' ' B' ' 99' ' ' GLN . 51.6 t -63.38 -54.24 35.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.297 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -75.8 -17.18 59.95 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.729 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 4.5 t0 59.99 43.84 14.11 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.584 0.707 . . . . 10.0 111.285 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 62.1 m -154.33 134.46 13.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.434 -0.803 . . . . 10.0 109.697 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -81.09 -22.94 38.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.827 0.346 . . . . 10.0 111.143 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -111.06 96.61 6.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.334 0.587 . . . . 10.0 111.278 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.84 157.51 77.68 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.376 -0.829 . . . . 10.0 109.951 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.71 99.19 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.543 2.162 . . . . 10.0 112.052 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.813 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 70.8 mtm -131.24 130.49 42.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.209 -0.451 . . . . 10.0 110.169 179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.693 ' HB ' HD23 ' B' ' 79' ' ' LEU . 59.5 t -117.6 133.44 64.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.95 -0.389 . . . . 10.0 109.95 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.565 HD12 ' HB2' ' B' ' 80' ' ' CYS . 26.3 tp -85.57 128.93 34.91 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.252 -0.277 . . . . 10.0 110.252 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.54 ' HB ' HG12 ' B' ' 81' ' ' VAL . 42.6 t -127.98 123.96 61.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.946 0.403 . . . . 10.0 111.403 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.78 111.55 4.22 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.236 -1.146 . . . . 10.0 110.236 178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -94.71 164.88 12.77 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.841 0.312 . . . . 10.0 111.841 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 97.1 mttt 63.6 45.97 4.4 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.547 0.689 . . . . 10.0 111.941 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.765 ' HA ' HD11 ' B' ' 84' ' ' ILE . 6.3 p -82.1 -15.79 52.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.456 -0.793 . . . . 10.0 111.722 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -84.28 -0.84 53.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.933 0.397 . . . . 10.0 111.381 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.59 128.17 49.67 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.378 -0.601 . . . . 10.0 109.378 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.95 -21.82 66.31 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.749 2.299 . . . . 10.0 112.543 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 3.8 p -82.48 52.99 2.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.439 -0.346 . . . . 10.0 111.167 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.485 ' NH2' ' HB2' ' B' ' 118' ' ' CYS . 17.9 ttm180 -86.2 128.94 34.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.744 0.307 . . . . 10.0 110.316 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.2 m -107.64 -43.41 4.51 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.944 0.402 . . . . 10.0 109.948 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 19.8 t -88.27 111.23 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.18 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.512 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 21.2 t70 -73.66 150.05 41.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.612 -0.267 . . . . 10.0 110.897 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.5 m -52.59 -43.93 65.63 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.8 -0.636 . . . . 10.0 112.431 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -64.51 -34.5 78.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.807 0.337 . . . . 10.0 111.586 -178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.512 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 41.5 mt-30 -61.81 -39.23 91.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.087 0.47 . . . . 10.0 110.858 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -77.04 -41.35 42.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.623 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -63.69 -42.44 98.0 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.38 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.12 -48.1 81.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.77 -179.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' B' ' 133' ' ' LEU . 12.4 tp -71.29 -33.94 70.2 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.266 -0.424 . . . . 10.0 111.095 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.06 77.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.43 -0.35 . . . . 10.0 110.768 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.672 ' CZ ' ' H82' ' B' ' 209' ' ' PCW . 28.8 tpt180 -63.35 -33.94 76.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.205 0.526 . . . . 10.0 110.521 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 19.7 m -75.19 -17.53 60.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.793 -0.639 . . . . 10.0 111.46 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -98.88 -19.56 17.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.604 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 85.81 37.43 9.4 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 10.0 111.86 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 18.4 pt -132.55 150.71 76.59 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.679 0.276 . . . . 10.0 111.198 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.0 Cg_exo -76.83 159.83 34.46 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.864 2.376 . . . . 10.0 111.934 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -130.04 133.9 47.03 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.423 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.741 HG21 ' HB2' ' B' ' 155' ' ' ALA . 27.1 mm -117.57 126.76 74.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.11 -0.495 . . . . 10.0 110.949 -179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . 1.035 ' HB3' ' H62' ' B' ' 204' ' ' PCW . 40.8 tt0 -108.89 106.67 16.76 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.777 -0.824 . . . . 10.0 108.777 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.643 ' HB ' HG22 ' B' ' 152' ' ' VAL . 0.7 OUTLIER -151.32 167.98 26.2 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -178.72 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 7.3 t -131.81 144.77 51.16 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.195 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -73.17 -21.79 60.62 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.708 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 2.6 ttpm? -77.58 -33.54 53.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.428 . . . . 10.0 110.523 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 23.8 m -82.42 -45.93 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.324 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.885 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 62.13 40.5 11.8 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.792 0.437 . . . . 10.0 111.394 179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -129.71 109.26 10.83 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.499 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 105.0 -16.01 47.05 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.446 -0.883 . . . . 10.0 113.467 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . 0.643 HG22 ' HB ' ' B' ' 144' ' ' THR . 3.9 t -66.2 -25.51 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.017 0.437 . . . . 10.0 110.58 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -61.07 -45.58 94.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.122 -0.49 . . . . 10.0 110.573 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . 0.535 ' OD1' ' H52' ' B' ' 212' ' ' PCW . 33.1 t70 -66.14 -28.03 68.48 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.456 0.539 . . . . 10.0 112.456 -178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . 0.741 ' HB2' HG21 ' B' ' 142' ' ' ILE . . . -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.263 0.554 . . . . 10.0 109.807 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -67.28 -38.42 85.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.56 -0.746 . . . . 10.0 110.987 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -65.98 -38.64 89.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.729 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.591 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 93.4 m -64.3 -39.22 93.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 10.0 109.78 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.678 HD22 ' HG ' ' B' ' 79' ' ' LEU . 63.2 tp -60.29 -42.84 96.32 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 70.4 t -63.21 -40.51 89.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.616 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.591 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 64.4 mtt180 -61.54 -35.43 77.74 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.192 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . 0.447 ' HA ' ' HE3' ' B' ' 165' ' ' LYS . 60.8 mm-40 -70.14 -43.24 71.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.149 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.432 HG13 ' O ' ' B' ' 159' ' ' LEU . 84.1 mt -58.66 -43.34 87.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.231 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' B' ' 164' ' ' ARG . 61.4 mtt180 -60.57 -39.09 86.77 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.705 0.288 . . . . 10.0 111.007 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.477 ' HB2' ' HE3' ' B' ' 165' ' ' LYS . 23.5 mtmt -73.35 -39.6 65.07 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.894 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 50.7 t-80 -54.15 -45.08 71.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.762 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.436 -0.347 . . . . 10.0 111.632 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -76.69 -41.95 43.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.96 0.409 . . . . 10.0 109.902 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -56.81 -46.68 81.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.81 -0.632 . . . . 10.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 33.1 mmt -62.26 -37.26 84.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.225 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 16.7 m -68.57 -32.78 72.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.045 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -80.09 -7.2 58.76 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.961 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -103.66 -46.79 4.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.84 0.352 . . . . 10.0 110.424 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.68 -75.29 2.15 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.909 -0.662 . . . . 10.0 112.175 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.544 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 0.2 OUTLIER -169.46 52.43 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.1 0.476 . . . . 10.0 110.27 -179.937 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 4.5 mtpm? -98.05 97.98 9.37 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.621 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -107.43 83.45 1.81 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.923 0.392 . . . . 10.0 111.348 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -165.56 113.02 0.95 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.928 -0.578 . . . . 10.0 111.027 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -121.23 125.35 46.9 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.243 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -116.05 103.29 10.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.444 -0.344 . . . . 10.0 110.642 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 14.2 t -100.38 135.02 42.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.141 0.496 . . . . 10.0 110.736 -179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -86.82 -39.56 15.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.317 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -140.45 131.81 26.76 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.13 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -87.85 -39.88 14.46 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.957 -0.386 . . . . 10.0 109.957 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.237 0.418 0 CA-C-N 115.752 -0.658 . . . . 10.0 111.87 179.535 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.292 0 CA-C-O 121.135 0.493 . . . . 10.0 110.201 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.65 124.53 26.87 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.925 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.1 tp -120.99 121.47 65.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.872 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.439 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 58.6 mtt180 -85.11 110.06 18.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 10.0 111.555 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 98.8 t -102.18 121.15 52.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.325 -0.621 . . . . 10.0 109.325 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . 0.438 ' HB2' ' O ' ' D' ' 426' ' ' LEU . 28.5 m-85 -107.46 130.37 54.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 10.0 110.936 179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.511 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 9.7 mp -96.23 166.76 13.63 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.141 -0.936 . . . . 10.0 109.172 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.511 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.3 Cg_endo -58.57 158.91 21.79 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.263 1.976 . . . . 10.0 111.805 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 49.8 t30 75.11 -93.77 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.43 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 2.0 ptpt -156.91 27.21 0.32 Allowed 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.021 0.378 . . . . 10.0 112.021 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -106.04 152.57 23.2 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.696 0.284 . . . . 10.0 110.53 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . 0.543 ' HD2' ' OE1' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -144.52 158.27 43.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.977 0.418 . . . . 10.0 111.184 -179.504 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.456 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 9.3 m -140.45 138.32 34.6 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.906 -0.776 . . . . 10.0 108.906 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.871 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.2 t -116.58 122.24 69.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 12.0 m -126.53 169.93 17.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.36 -0.382 . . . . 10.0 111.103 -179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.447 ' HB2' HD11 ' B' ' 36' ' ' ILE . 24.5 t-20 -120.24 116.22 25.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.225 -179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 17.2 m -86.92 164.2 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.831 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.6 OUTLIER -161.22 151.07 17.09 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.174 -0.306 . . . . 10.0 110.174 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 65.34 -88.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.617 0.573 . . . . 10.0 111.854 179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -157.06 91.73 0.12 Allowed Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.917 -0.873 . . . . 10.0 110.917 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 58.0 mtt -120.49 116.91 26.34 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.935 0.398 . . . . 10.0 110.962 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' D' ' 417' ' ' ASP . 0.4 OUTLIER -82.79 171.37 14.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.388 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' D' ' 416' ' ' THR . 74.7 mt -57.65 -39.67 77.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.741 0.305 . . . . 10.0 111.519 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -61.64 -42.49 98.98 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.464 -0.335 . . . . 10.0 110.86 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -64.49 -42.24 95.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.772 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 24.2 m -67.85 -40.76 83.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.207 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.819 HD21 HG21 ' D' ' 428' ' ' VAL . 14.2 mt -69.96 -32.34 70.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.088 -0.505 . . . . 10.0 111.827 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 40.1 ttp -57.64 -29.02 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.555 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.8 mmtp -66.41 -34.28 77.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.373 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -88.23 -25.86 22.66 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.071 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 1.6 mp -51.62 -49.48 62.13 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -67.88 -27.66 66.86 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 113.11 0.782 . . . . 10.0 113.11 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.591 ' CG1' HD13 ' B' ' 21' ' ' ILE . 67.3 t -82.61 -55.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.687 0.28 . . . . 10.0 111.043 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 4.2 mmt180 -65.28 -41.01 94.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.343 -0.39 . . . . 10.0 111.82 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 83.56 30.6 29.53 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.822 -0.704 . . . . 10.0 113.442 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 80.8 mt -107.88 151.41 25.8 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 122.653 -0.322 . . . . 10.0 110.147 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -92.32 130.74 36.59 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.867 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -67.82 -11.99 33.9 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.939 2.426 . . . . 10.0 112.622 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -65.02 -25.47 67.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.597 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 14.0 m -104.9 4.9 32.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.928 0.394 . . . . 10.0 111.186 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 33.5 m -106.07 162.07 13.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.054 0.454 . . . . 10.0 111.048 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -136.21 144.79 45.1 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.917 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.31 115.92 32.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.178 0.513 . . . . 10.0 112.027 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -119.74 159.22 24.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.564 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.434 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 14.1 ptm180 -120.6 -170.24 1.96 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.581 -0.526 . . . . 10.0 109.581 179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . 0.58 HD13 ' HB2' ' D' ' 425' ' ' GLU . 29.0 tp -69.58 143.09 53.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.15 99.18 0.86 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' D' ' 403' ' ' GLN . 12.6 pt20 -72.96 63.47 0.65 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.327 -179.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 60.66 58.84 2.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.397 0.618 . . . . 10.0 111.735 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 10.8 t-80 -104.28 171.06 7.54 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.157 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -77.66 -13.81 59.8 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.886 0.374 . . . . 10.0 110.927 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 140.72 46.37 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.675 -0.774 . . . . 10.0 112.712 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 37.0 tttp -136.78 135.25 37.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.701 0.286 . . . . 10.0 110.597 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 63.0 mttt -68.99 127.33 32.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.548 . . . . 10.0 110.164 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . 0.434 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -80.93 108.96 15.05 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 32.4 ttp180 -79.76 140.94 36.74 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.181 0.437 . . . . 10.0 112.181 -178.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.435 HD13 HG21 ' D' ' 416' ' ' THR . 21.0 mt -121.7 -148.3 0.4 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.975 179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . 0.431 ' H ' ' HB3' ' D' ' 412' ' ' LEU . 10.9 t70 -130.06 164.31 24.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -77.05 -23.37 52.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.048 0.451 . . . . 10.0 110.722 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -78.02 -16.15 58.33 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.745 -0.661 . . . . 10.0 111.412 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.494 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 26.3 m -56.68 134.83 55.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.773 0.32 . . . . 10.0 110.294 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . 0.663 ' HA ' ' HA ' ' D' ' 377' ' ' SER . 6.3 t70 -84.29 150.51 25.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.952 0.406 . . . . 10.0 111.018 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -80.71 -19.36 45.26 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.138 -0.483 . . . . 10.0 111.387 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.48 -34.49 76.02 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.215 0.531 . . . . 10.0 110.777 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.91 -24.34 62.44 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.815 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.5 mp -106.24 30.93 5.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.176 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 12.5 tt -60.27 119.72 4.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.755 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.59 -0.63 80.55 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.776 -0.726 . . . . 10.0 113.131 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -92.85 165.77 12.74 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 117.064 0.432 . . . . 10.0 110.25 179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.58 ' HB2' HD13 ' D' ' 401' ' ' LEU . 22.2 mt-10 -109.83 106.54 16.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.437 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.438 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 8.8 tp -81.1 163.91 22.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.3 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -145.54 132.28 20.01 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.741 0.305 . . . . 10.0 110.401 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.819 HG21 HD21 ' D' ' 382' ' ' LEU . 57.9 t -122.15 97.62 5.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.531 -0.544 . . . . 10.0 109.531 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -107.96 171.58 7.32 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -94.0 159.16 15.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.576 -179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.466 ' HB2' ' H ' ' D' ' 432' ' ' ASP . 0.5 OUTLIER -80.25 -83.08 0.11 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.087 -0.506 . . . . 10.0 109.908 179.218 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 23.5 t70 -161.62 90.86 0.8 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.412 -0.813 . . . . 10.0 109.289 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -145.66 -95.73 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.253 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.32 89.16 50.63 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-O 121.143 0.497 . . . . 10.0 111.101 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.36 139.27 23.19 Favored 'Trans proline' 0 C--O 1.237 0.46 0 C-N-CA 122.841 2.361 . . . . 10.0 113.045 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 8.7 tp 66.12 159.1 0.12 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.662 -0.699 . . . . 10.0 112.648 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 467' ' ' THR . 8.2 m -93.94 131.2 39.61 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.886 -0.413 . . . . 10.0 109.886 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.88 170.61 13.88 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.313 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . 0.463 ' HA ' ' SG ' ' D' ' 468' ' ' CYS . 39.0 t60 -55.68 129.04 37.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.061 0.457 . . . . 10.0 111.171 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -99.98 135.52 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.993 -0.549 . . . . 10.0 111.123 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -93.17 122.11 35.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.856 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -143.58 103.34 4.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.693 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . 0.435 ' HB3' ' CE1' ' D' ' 463' ' ' PHE . 13.1 ptm180 -88.14 91.97 8.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.123 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -146.19 176.13 9.98 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.892 -179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . 0.964 HG21 ' H52' ' D' ' 501' ' ' PCW . 0.5 OUTLIER -72.79 162.15 29.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.383 -179.65 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -89.97 -168.82 2.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.06 -0.518 . . . . 10.0 111.879 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . 0.488 HD12 ' O ' ' B' ' 45' ' ' VAL . 30.6 mt -101.39 -37.52 8.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.358 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . 0.695 ' HD3' ' HA ' ' B' ' 47' ' ' ASP . 49.5 tttt -159.74 176.31 12.11 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.746 -0.835 . . . . 10.0 108.746 179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . 0.599 ' H ' ' HG2' ' D' ' 448' ' ' LYS . 44.9 mt -58.08 101.09 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.67 0.607 . . . . 10.0 110.656 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . 0.729 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -100.82 165.52 11.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.231 -0.44 . . . . 10.0 110.839 -178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -115.32 142.37 46.78 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.267 -0.642 . . . . 10.0 109.267 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.657 ' HA ' HD23 ' D' ' 459' ' ' LEU . 11.5 t -67.6 128.73 37.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.0 0.428 . . . . 10.0 110.505 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.87 -1.87 57.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.179 0.514 . . . . 10.0 109.752 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 44.5 mm -110.55 -54.0 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.089 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.4 m -92.43 -162.91 0.98 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.394 0.616 . . . . 10.0 111.481 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -123.97 58.95 1.16 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.13 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . 0.556 ' HG2' ' H ' ' D' ' 458' ' ' PHE . 2.3 ttmp? -160.57 174.79 13.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 -179.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . 0.556 ' H ' ' HG2' ' D' ' 457' ' ' LYS . 28.4 p90 -72.95 153.21 41.06 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.088 0.471 . . . . 10.0 110.442 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.657 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.1 OUTLIER -95.78 115.96 28.2 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.973 -0.558 . . . . 10.0 110.231 179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.48 ' HG ' ' H ' ' D' ' 460' ' ' LEU . 0.9 OUTLIER -82.17 -166.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.605 178.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -77.38 64.14 2.69 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.55 0.69 . . . . 10.0 111.158 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -91.3 -99.17 1.25 Allowed Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.383 -0.826 . . . . 10.0 112.611 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' D' ' 443' ' ' ARG . 55.1 m-85 -134.0 142.4 47.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.857 0.36 . . . . 10.0 111.735 -179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.489 ' NH2' HG12 ' B' ' 44' ' ' VAL . 7.3 ptm180 -150.69 131.05 13.71 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.524 -0.917 . . . . 10.0 108.524 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.97 160.14 32.57 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 113.095 0.776 . . . . 10.0 113.095 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -91.72 -62.05 1.51 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.243 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . 0.427 HG21 HG21 ' D' ' 437' ' ' THR . 0.2 OUTLIER -66.44 -47.97 71.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.536 178.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.1 OUTLIER -88.82 -164.37 1.13 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.601 -0.727 . . . . 10.0 109.402 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . -160.1 69.99 0.24 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 119.63 -1.271 . . . . 10.0 113.964 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -112.91 139.79 48.26 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 177.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.651 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 6.9 pttp -109.22 110.21 21.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.227 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.993 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 32.8 p90 -142.92 163.61 32.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.252 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -93.58 -171.82 2.72 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.241 -0.651 . . . . 10.0 109.241 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.06 -15.08 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.151 0.5 . . . . 10.0 109.689 179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 17.4 m80 -93.99 -31.44 14.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.883 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.993 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.6 m -78.36 -20.46 51.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 111.878 0.325 . . . . 10.0 111.878 -179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.94 -45.39 51.15 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.241 0.46 . . . . 10.0 112.241 -178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.94 32.04 5.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.467 0.651 . . . . 10.0 110.282 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.572 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 50.3 tttm -122.04 -31.82 3.82 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.025 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.5 p -76.33 120.37 81.39 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.918 -0.583 . . . . 10.0 110.581 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -76.44 -35.8 2.02 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.228 1.952 . . . . 10.0 112.072 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.69 100.86 11.14 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.144 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 23.6 tpp -79.16 174.88 11.11 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.632 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.548 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 64.2 m -74.14 74.98 1.77 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.386 0.513 . . . . 10.0 112.386 -179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.09 89.04 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.041 -0.726 . . . . 10.0 109.041 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.04 150.08 27.61 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.766 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 1.4 p90 . . . . . 0 C--N 1.324 -0.529 0 CA-C-N 116.452 -0.34 . . . . 10.0 111.159 179.727 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 0.713 H442 H261 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 0.839 H272 H241 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.041 ' C16' H212 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 0.923 ' C35' H162 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.149 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.829 H451 H182 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.037 H431 H232 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.023 H221 H181 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.016 ' H63' H141 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.956 ' H72' H252 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 0.902 H472 H251 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 0.995 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.108 H361 H152 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 0.979 H272 H482 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.046 H432 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.091 H442 ' H20' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.09 H451 ' H75' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.942 H461 ' C42' ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 0.986 H131 ' H60' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.088 ' H2 ' ' H41' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 0.966 H381 ' H36' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.13 H182 H362 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.006 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.078 H141 H171 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.078 H171 H141 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.878 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.068 H172 H351 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.108 H152 H361 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.13 H362 H182 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 1.014 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.034 ' H51' ' O5 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.055 ' C39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.091 ' H20' H442 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.063 H461 H251 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 0.928 H452 H261 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 1.017 H283 ' H35' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.071 H412 ' H77' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.071 H242 H242 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.152 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.062 H261 H421 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.055 H242 ' H63' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 0.928 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.042 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.071 ' C7 ' H18A ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 1.12 ' H67' ' H36' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 1.001 ' H78' ' H40' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.004 ' H9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.011 ' H31' H212 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.071 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 0.94 H181 H251 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.06 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 0.986 H252 H122 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.081 ' H11' ' H8A' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.047 H181 H342 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.055 H461 ' H68' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.047 H342 H181 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.036 ' C22' H161 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.945 H351 ' H51' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.124 H282 H212 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.063 H251 H461 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 0.998 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.055 ' H68' H461 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.081 ' H8A' ' H11' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.12 ' H36' ' H67' ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.742 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . 0.742 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 0.964 ' H52' HG21 ' D' ' 445' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 0.803 H382 H151 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.124 H212 H282 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.016 H121 H171 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.066 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.079 ' H40' H251 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.046 H471 ' H32' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.091 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.065 ' H51' ' H12' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 0.974 H432 H472 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.09 ' H75' H451 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.04 ' H30' ' H35' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.046 ' H32' H471 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.04 ' H35' ' H30' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.046 H211 H432 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.079 H251 ' H40' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 204' ' ' LEU . 90.5 mt . . . . . 0 N--CA 1.457 -0.119 0 CA-C-O 120.651 0.262 . . . . 10.0 110.859 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -60.78 -44.57 96.62 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.806 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.47 -46.8 81.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.9 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.414 HD12 HD23 ' A' ' 201' ' ' LEU . 25.5 mt -63.13 -44.89 94.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.998 -0.546 . . . . 10.0 111.852 -178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -64.74 -43.81 92.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.459 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -72.15 -31.44 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.052 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 23.4 t90 -66.41 -36.89 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.075 -0.511 . . . . 10.0 109.932 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -59.31 -35.89 74.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 10.0 111.39 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 2.5 m -67.51 -24.7 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.472 179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 38.5 t -80.8 -45.41 21.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 1.5 m -60.18 -43.44 95.87 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.927 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.7 p -64.9 -38.45 91.0 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.641 -0.503 . . . . 10.0 109.641 179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.6 m -65.14 -41.61 94.62 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.958 -0.564 . . . . 10.0 109.998 178.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.69 -40.04 93.59 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-N 116.352 -0.385 . . . . 10.0 109.981 178.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 19.3 m -65.34 -44.19 88.53 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.01 -0.541 . . . . 10.0 109.591 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 39.6 mmtt -62.47 -43.8 97.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.33 0.586 . . . . 10.0 109.55 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 89.5 mt -64.28 -40.58 96.26 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.647 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -61.32 -37.87 84.81 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.911 0.386 . . . . 10.0 110.719 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -70.16 -25.57 63.51 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.312 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -85.98 -36.0 20.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.993 -0.549 . . . . 10.0 109.902 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 81.7 mt -54.7 -36.57 64.83 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 115.934 -0.575 . . . . 10.0 111.432 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -56.01 -69.74 1.18 Allowed Glycine 0 N--CA 1.452 -0.285 0 N-CA-C 111.265 -0.734 . . . . 10.0 111.265 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -53.4 -39.43 81.72 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.902 2.401 . . . . 10.0 111.538 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 39.7 t -59.31 -51.96 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.685 -0.234 . . . . 10.0 110.972 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 22.5 p -68.42 -43.95 76.06 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.691 -0.231 . . . . 10.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -58.79 -39.08 80.03 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 120.785 0.326 . . . . 10.0 111.011 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.26 -44.02 60.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.012 0.434 . . . . 10.0 109.899 178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.02 -44.45 97.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.486 -0.779 . . . . 10.0 110.816 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.498 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 2.1 m95 -62.82 -44.67 95.53 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.464 -0.334 . . . . 10.0 110.867 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.76 -41.96 97.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.873 0.368 . . . . 10.0 110.814 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.769 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 35.4 m-20 -68.22 -38.74 82.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.424 178.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 5.3 mt -66.7 -34.28 77.51 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.554 -0.535 . . . . 10.0 109.554 178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.52 -29.7 68.35 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.16 179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.769 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 59.6 mttt -68.29 -35.53 77.98 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.16 -1.052 . . . . 10.0 108.16 177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.24 -45.54 80.28 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.16 -0.927 . . . . 10.0 108.948 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.49 ' HB ' ' CZ ' ' A' ' 240' ' ' ARG . 0.0 OUTLIER -68.82 -31.43 70.41 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 109.848 -0.427 . . . . 10.0 109.848 178.848 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -58.09 -50.16 74.41 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 108.176 -1.046 . . . . 10.0 108.176 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -65.85 -43.52 93.73 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 110.631 -0.988 . . . . 10.0 110.631 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 236' ' ' THR . 17.6 mt -60.2 -35.89 76.43 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.078 0.399 . . . . 10.0 112.078 179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.49 ' CZ ' ' HB ' ' A' ' 236' ' ' THR . 43.6 mtt180 -69.36 -37.37 77.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.892 0.377 . . . . 10.0 110.076 179.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -73.29 -42.53 62.31 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.911 -0.774 . . . . 10.0 108.911 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -64.7 -27.15 68.72 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.007 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 30.2 ttm -61.29 -27.72 68.68 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.308 179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.643 ' HA ' ' HG3' ' A' ' 248' ' ' GLU . 6.3 m -75.15 3.31 8.87 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 121.417 0.627 . . . . 10.0 110.621 179.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 48.9 mttm -133.11 -56.92 0.92 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.765 -0.652 . . . . 10.0 109.764 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.653 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 2.4 t70 -54.47 -43.66 71.92 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.751 -179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.487 ' O ' HG12 ' A' ' 250' ' ' VAL . 39.1 mt -101.59 -38.11 8.08 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.968 0.358 . . . . 10.0 111.968 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 244' ' ' SER . 6.9 mm-40 -65.63 -44.35 86.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.863 0.364 . . . . 10.0 111.959 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 97.9 mt-10 -71.97 -34.81 69.26 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.781 -0.368 . . . . 10.0 110.792 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.539 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.4 p -67.13 -29.74 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 C-N-CA 120.659 -0.416 . . . . 10.0 110.822 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.458 ' O ' HG12 ' A' ' 254' ' ' VAL . 92.5 mttt -76.33 -36.69 58.14 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.319 -0.622 . . . . 10.0 109.319 178.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -73.58 -35.37 65.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.323 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 12.3 mtpt -81.44 -31.67 32.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.974 -0.557 . . . . 10.0 111.948 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 1.5 p -57.54 -27.78 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.082 0 N-CA-C 111.898 0.333 . . . . 10.0 111.898 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.585 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.0 mt-30 -62.83 -65.16 2.3 Favored Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 119.342 -0.361 . . . . 10.0 110.64 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.585 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 40.6 Cg_endo -69.44 -22.3 33.74 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 121.936 1.757 . . . . 10.0 111.779 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.411 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 2.7 m-30 -66.96 -59.16 3.73 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 24.8 mt -66.69 -29.83 69.93 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.345 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.57 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 10.1 t70 -61.92 -42.7 99.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 10.0 109.934 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.98 -47.24 75.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.256 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -62.4 -50.04 73.11 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.782 -0.645 . . . . 10.0 110.714 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -63.68 -33.12 74.92 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.096 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 259' ' ' ASP . 8.3 ttmm -63.85 -49.55 72.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.986 -0.746 . . . . 10.0 108.986 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.52 ' NZ ' ' HB2' ' C' ' 513' ' ' ALA . 74.4 mttt -69.51 -39.82 77.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.571 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -64.67 -34.52 78.48 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.568 -0.287 . . . . 10.0 110.815 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -65.8 -45.21 83.25 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.411 -0.588 . . . . 10.0 109.411 178.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 48.3 mt-10 -66.69 -37.55 84.95 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.929 -0.767 . . . . 10.0 108.929 177.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.484 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 9.0 mt-10 -60.17 -47.97 83.68 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.908 -0.587 . . . . 10.0 109.562 178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 16.9 mmt -67.01 -35.29 79.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.624 -0.716 . . . . 10.0 110.558 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.93 -49.37 76.41 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.237 -0.653 . . . . 10.0 109.237 178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 72.4 mt -63.61 -39.05 93.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.604 179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.413 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 1.5 m-85 -60.92 -48.26 82.65 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.991 -0.55 . . . . 10.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . . . . . . . . . 57.5 mtt180 -68.92 -31.28 70.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.457 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -72.59 -41.29 65.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.912 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.763 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -82.69 -30.91 28.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.119 -0.491 . . . . 10.0 112.002 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.413 ' HB ' ' O ' ' A' ' 272' ' ' TYR . 3.3 p -58.41 -33.2 47.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.452 ' HB2' ' CD ' ' A' ' 278' ' ' PRO . 2.2 mm-40 -61.42 -62.82 5.17 Favored Pre-proline 0 CA--C 1.536 0.404 0 CA-C-O 119.495 -0.288 . . . . 10.0 111.462 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 277' ' ' GLU . 17.3 Cg_endo -60.06 -40.48 60.72 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 121.86 1.707 . . . . 10.0 111.489 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 25.3 mt -61.51 -41.69 97.68 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.635 0.255 . . . . 10.0 110.999 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 -65.46 -36.44 83.9 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.433 -0.58 . . . . 10.0 109.433 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -68.48 -45.89 71.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.58 . . . . 10.0 109.879 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 92.6 mt-10 -59.21 -46.81 87.46 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.928 179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.3 -31.49 71.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.599 -0.728 . . . . 10.0 110.961 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -69.9 -55.18 10.41 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.925 0.393 . . . . 10.0 110.137 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.45 -37.97 89.4 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.046 0.451 . . . . 10.0 109.968 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.34 -41.14 94.7 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.543 -0.753 . . . . 10.0 111.826 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.09 83.17 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 109.608 -0.515 . . . . 10.0 109.608 178.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -57.81 -44.6 86.48 Favored 'General case' 0 C--O 1.224 -0.237 0 O-C-N 123.563 0.539 . . . . 10.0 110.627 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -63.27 -47.16 83.53 Favored 'General case' 0 C--O 1.231 0.081 0 CA-C-O 120.956 0.408 . . . . 10.0 110.199 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -65.63 -41.53 92.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.501 . . . . 10.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 35.8 mt -65.41 -42.66 92.33 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.321 -0.4 . . . . 10.0 111.202 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 45.2 m170 -63.6 -39.15 93.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.885 -0.413 . . . . 10.0 109.885 178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -64.25 -40.56 96.27 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.17 -0.678 . . . . 10.0 109.17 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.31 -41.95 96.59 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.796 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . 0.542 ' HA ' ' HB2' ' A' ' 298' ' ' LEU . 47.5 mt-30 -63.86 -34.11 77.2 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.57 -0.741 . . . . 10.0 110.407 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -66.51 -15.47 63.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.09 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.537 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 24.0 mmtp -112.96 -4.55 13.89 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.842 178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.542 ' HB2' ' HA ' ' A' ' 295' ' ' GLN . 12.7 mt -90.6 -43.43 10.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.786 -0.643 . . . . 10.0 111.027 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.797 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 20.1 m -79.79 -62.86 0.39 Allowed Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 112.729 0.64 . . . . 10.0 112.729 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.797 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 53.0 Cg_exo -59.35 -58.86 0.52 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.506 2.138 . . . . 10.0 112.181 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 74.1 mt -67.47 -24.61 65.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.949 0.404 . . . . 10.0 110.684 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.75 -43.31 67.65 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.312 -1.115 . . . . 10.0 110.312 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.89 -41.57 96.3 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.136 -0.69 . . . . 10.0 109.136 178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -61.91 -42.78 99.49 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.284 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 9.4 tpt -62.63 -40.93 98.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 10.0 109.973 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.416 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 21.2 mtt180 -68.14 -41.2 81.97 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' A' ' 310' ' ' ARG . 39.0 t70 -65.17 -42.38 93.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.25 0.548 . . . . 10.0 110.336 179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.609 ' HG3' HD21 ' C' ' 469' ' ' LEU . 20.8 mmt180 -68.49 -32.68 72.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.639 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -65.87 -32.6 74.21 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 109.46 -0.57 . . . . 10.0 109.46 178.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' A' ' 307' ' ' ASP . 77.6 mtt180 -59.64 -51.13 71.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.661 -0.866 . . . . 10.0 108.661 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -71.02 -37.66 72.61 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.265 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.1 OUTLIER -52.21 -55.19 22.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.593 179.221 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.561 ' HA ' HD12 ' A' ' 316' ' ' LEU . 15.3 t -78.42 -31.15 15.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.515 -0.766 . . . . 10.0 111.886 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 12.8 t70 -62.24 -44.69 95.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.671 -0.412 . . . . 10.0 110.059 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.65 -33.3 73.71 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.098 -0.705 . . . . 10.0 109.098 178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 313' ' ' VAL . 60.5 mt -70.5 -50.97 32.28 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.614 -0.721 . . . . 10.0 109.67 178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 10.5 mtm105 -59.14 -45.55 90.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.235 -179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -66.12 -23.39 66.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.1 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -89.4 -42.9 11.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.274 -0.421 . . . . 10.0 110.493 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.513 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 90.5 mt -71.24 -25.97 62.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.574 . . . . 10.0 112.548 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.453 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -53.59 -57.63 16.42 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 121.326 -0.149 . . . . 10.0 111.278 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.477 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 44.0 Cg_endo -72.03 -34.51 8.29 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 121.136 1.224 . . . . 10.0 111.02 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.513 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.9 m-30 -57.98 -50.51 73.16 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.462 -0.335 . . . . 10.0 111.495 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.535 ' HA ' HD12 ' A' ' 327' ' ' LEU . 13.1 p -61.05 -36.08 78.63 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.917 0.389 . . . . 10.0 110.674 -179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -66.65 -45.88 77.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.666 178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 44.4 mt-10 -65.87 -30.43 71.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.679 -0.692 . . . . 10.0 110.089 178.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.653 HD23 ' HD2' ' A' ' 330' ' ' ARG . 62.9 mt -66.35 -33.99 76.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 108.6 -0.889 . . . . 10.0 108.6 177.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 324' ' ' SER . 88.6 mtt180 -67.96 -36.47 80.13 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 108.656 -0.868 . . . . 10.0 108.656 178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -66.67 -37.92 85.77 Favored 'General case' 0 N--CA 1.456 -0.141 0 N-CA-C 108.098 -1.075 . . . . 10.0 108.098 177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.653 ' HD2' HD23 ' A' ' 327' ' ' LEU . 31.6 mtt-85 -63.84 -47.63 79.98 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.922 -0.769 . . . . 10.0 108.922 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 85.4 mt -60.01 -41.21 91.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.476 -0.784 . . . . 10.0 110.327 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.44 94.42 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.052 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -65.93 -45.95 80.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.506 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.661 ' HD3' ' OE1' ' C' ' 440' ' ' GLU . 29.3 mmt180 -59.77 -48.4 81.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.203 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 90.5 mt -66.15 -34.81 78.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.879 -0.6 . . . . 10.0 111.491 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -64.4 -45.67 86.61 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.891 0.377 . . . . 10.0 110.677 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.93 -44.38 89.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.436 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 88.8 mt -72.78 -7.64 51.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.297 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -89.82 -53.18 4.61 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.976 -0.749 . . . . 10.0 108.976 178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -65.35 -54.79 23.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.729 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.446 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 23.6 t-20 -67.69 -34.86 77.73 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.028 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -61.53 -46.39 94.4 Favored Glycine 0 N--CA 1.45 -0.386 0 N-CA-C 111.647 -0.581 . . . . 10.0 111.647 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.17 -40.29 98.78 Favored Glycine 0 N--CA 1.451 -0.319 0 N-CA-C 110.763 -0.935 . . . . 10.0 110.763 178.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.62 97.65 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.671 -0.492 . . . . 10.0 109.671 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 44.7 mtm180 -62.67 -41.19 98.95 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.892 -0.595 . . . . 10.0 110.426 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 86.9 mt -64.27 -44.51 91.47 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.76 95.88 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.828 -0.624 . . . . 10.0 109.553 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -66.8 -41.03 88.23 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.368 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -60.18 -42.62 95.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.023 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -65.11 -42.69 93.75 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.202 -0.454 . . . . 10.0 110.017 179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -62.82 -48.22 80.04 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 9.1 mtmm -60.68 -43.24 97.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.937 178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.21 -41.86 98.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.56 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 63.0 m -59.59 -46.11 89.92 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.094 0.473 . . . . 10.0 109.907 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.66 -49.8 67.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 10.0 109.971 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -56.59 -41.51 77.12 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.587 -0.733 . . . . 10.0 111.169 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 43.5 mt -65.26 -39.61 92.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.124 0.487 . . . . 10.0 110.302 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 53.6 m -62.29 -40.91 97.84 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.272 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -78.4 -24.85 46.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 10.0 109.806 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 55.5 tp -70.87 -30.56 66.97 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.953 -1.129 . . . . 10.0 107.953 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . 0.417 ' HB3' ' HE2' ' A' ' 365' ' ' LYS . 50.1 m -64.69 -28.82 69.86 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.423 178.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 6.2 mm-40 -70.79 -25.32 62.82 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.564 0.697 . . . . 10.0 109.575 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.713 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 63.5 tttt -93.87 -27.53 16.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.537 -0.756 . . . . 10.0 109.857 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -85.84 -23.9 26.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.711 -0.677 . . . . 10.0 112.211 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.846 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.1 mtmt -110.52 -76.46 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 112.657 0.614 . . . . 10.0 112.657 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.846 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 37.2 Cg_exo -57.55 -53.35 4.71 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 121.952 1.768 . . . . 10.0 112.788 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.713 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.75 -51.17 70.48 Favored 'General case' 0 C--O 1.226 -0.144 0 N-CA-C 111.598 0.222 . . . . 10.0 111.598 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 368' ' ' LEU . 3.3 mt -59.24 -34.74 72.57 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 116.785 -0.189 . . . . 10.0 110.98 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 4.6 tt0 -64.37 -48.0 77.15 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.479 -0.563 . . . . 10.0 109.479 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -61.48 -39.05 89.51 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.359 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 367' ' ' ALA . 96.2 mt -62.0 -48.35 80.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.91 179.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 82.3 mtt180 -66.62 -37.58 85.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.345 -0.388 . . . . 10.0 111.095 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -65.25 -25.38 67.64 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.216 -0.447 . . . . 10.0 109.899 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.96 -32.92 9.36 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.669 -0.972 . . . . 10.0 110.669 178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 42.9 mt -67.03 -35.56 80.16 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 122.343 0.257 . . . . 10.0 111.173 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . . . . . . . . . 92.1 mt -54.35 -61.48 5.45 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 123.162 0.289 . . . . 10.0 111.774 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.42 -34.36 34.64 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 121.837 1.692 . . . . 10.0 111.633 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 4.4 t -62.34 -49.22 84.81 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-O 120.799 0.333 . . . . 10.0 110.723 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.8 mt -65.2 -29.64 70.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 120.99 0.424 . . . . 10.0 109.928 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.401 ' O ' HG23 ' A' ' 384' ' ' VAL . 18.0 mm-40 -65.71 -46.2 79.87 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.209 178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.78 -34.64 78.27 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.67 -0.493 . . . . 10.0 109.67 178.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -60.67 -42.91 98.03 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.028 178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -59.37 -40.52 86.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.877 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 380' ' ' GLU . 12.8 t -64.86 -45.64 94.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.418 -0.355 . . . . 10.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.1 p -68.38 -37.78 80.73 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.18 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.573 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 9.7 m-85 -68.54 -43.87 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.727 179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 33.6 mt -59.84 -47.48 85.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.717 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.504 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -65.55 -33.38 75.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.917 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.11 90.33 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.397 -0.594 . . . . 10.0 109.397 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 84.7 mt -60.25 -41.2 92.71 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.114 -0.698 . . . . 10.0 109.114 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 29.4 mt-10 -62.14 -53.82 49.92 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.304 -0.862 . . . . 10.0 109.736 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -53.66 -40.87 66.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.535 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -66.69 -48.28 69.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.467 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.0 m -70.84 -28.26 64.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.392 0.516 . . . . 10.0 112.392 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.407 ' HB2' ' HE3' ' A' ' 395' ' ' LYS . 50.4 mtmt -77.58 -28.65 51.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.263 0.468 . . . . 10.0 112.263 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.751 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 13.9 mptt -101.12 -33.59 10.06 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.87 -2.17 56.97 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.895 0.332 . . . . 10.0 111.895 -179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.553 179.313 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.911 0.386 . . . . 10.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -99.96 10.82 40.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.979 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.01 -41.62 98.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.521 . . . . 10.0 110.435 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 17.1 mt -62.42 -40.25 95.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.91 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -63.67 -45.5 89.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.249 -0.887 . . . . 10.0 110.605 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.577 ' O ' HG23 ' C' ' 408' ' ' VAL . 20.0 t-20 -65.91 -39.8 90.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.559 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -63.23 -30.35 71.51 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.934 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.89 -45.55 85.48 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.112 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.7 m -62.93 -31.27 72.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.025 178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.577 HG23 ' O ' ' C' ' 404' ' ' ASN . 59.6 t -67.72 -40.66 84.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 N-CA-C 107.967 -1.123 . . . . 10.0 107.967 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 31.2 m -64.31 -38.46 91.11 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.269 -0.878 . . . . 10.0 109.517 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 6.9 m -59.25 -47.93 83.53 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.465 -0.569 . . . . 10.0 109.465 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 17.6 p -66.57 -33.13 74.98 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.203 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.442 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 3.0 m-30 -61.54 -49.76 75.41 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 178.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' C' ' 417' ' ' GLU . 6.2 m -62.18 -38.77 90.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.824 -0.626 . . . . 10.0 110.014 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.38 -39.52 94.03 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.083 0.468 . . . . 10.0 110.32 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' C' ' 411' ' ' THR . 83.0 mt -65.93 -38.16 87.93 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.492 -0.559 . . . . 10.0 109.492 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 80.0 mtt180 -65.84 -35.43 80.65 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.499 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' C' ' 413' ' ' SER . 87.9 mt-10 -62.48 -34.68 77.33 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.11 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -81.15 -46.05 15.49 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.125 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 34.7 mt -48.55 -49.33 36.84 Favored 'General case' 0 C--O 1.226 -0.15 0 N-CA-C 112.696 0.628 . . . . 10.0 112.696 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -50.22 -75.88 0.19 Allowed Glycine 0 CA--C 1.519 0.333 0 C-N-CA 121.21 -0.519 . . . . 10.0 113.529 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 50.1 Cg_exo -54.86 -45.16 43.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.951 2.434 . . . . 10.0 112.71 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 45.1 t -57.0 -47.4 83.53 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 N-CA-C 112.409 0.522 . . . . 10.0 112.409 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 37.5 p -67.86 -34.72 77.24 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.584 -0.447 . . . . 10.0 110.411 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -63.76 -50.47 68.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.535 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 11.5 pt-20 -71.8 -27.87 63.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 10.0 110.42 178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' C' ' 422' ' ' VAL . 29.4 t80 -67.06 -40.14 87.02 Favored 'General case' 0 C--N 1.333 -0.13 0 N-CA-C 108.969 -0.752 . . . . 10.0 108.969 178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -65.85 -39.7 91.03 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 108.786 -0.82 . . . . 10.0 108.786 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -63.55 -40.78 97.89 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.21 -0.904 . . . . 10.0 108.632 177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -64.17 -44.14 92.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.394 -0.821 . . . . 10.0 109.036 177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 71.8 mt -58.68 -38.67 78.71 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.757 -0.656 . . . . 10.0 110.278 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -66.48 -37.97 86.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.266 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 24.5 mttp -67.23 -45.71 75.97 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -64.53 -47.06 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.325 -0.852 . . . . 10.0 111.057 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.4 p -60.25 -48.75 80.4 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 121.399 -0.121 . . . . 10.0 111.234 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 10.8 mm-40 -63.11 -44.65 95.08 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 123.111 0.257 . . . . 10.0 110.662 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -60.84 -50.38 68.14 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.886 -0.886 . . . . 10.0 110.886 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 26.0 mt -63.22 -30.91 71.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.76 -0.22 . . . . 10.0 110.733 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -64.58 -41.12 96.48 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.643 -0.502 . . . . 10.0 109.643 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.535 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 80.4 mt-30 -66.73 -38.44 86.69 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.274 0.559 . . . . 10.0 109.904 179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.661 ' OE1' ' HD3' ' A' ' 334' ' ' ARG . 39.2 mt-10 -69.05 -48.73 62.08 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.764 -0.653 . . . . 10.0 109.757 178.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 93.7 mmm -67.58 -36.76 81.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.601 0.963 . . . . 10.0 113.601 -178.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 8.6 p -61.41 -51.6 68.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.005 0.431 . . . . 10.0 109.994 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -66.63 -32.89 74.5 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.668 -0.493 . . . . 10.0 109.668 178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.4 t0 -64.22 -52.71 57.51 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.932 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 98.1 mt -67.34 -45.4 76.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.831 -0.622 . . . . 10.0 112.133 -179.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -59.25 -47.57 84.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.137 0.494 . . . . 10.0 110.758 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' C' ' 451' ' ' LYS . 11.4 tt0 -70.07 -31.07 68.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.553 179.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . . . . . . . . . 1.1 t -60.17 -36.98 71.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.462 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -62.08 -43.25 99.24 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.762 -0.829 . . . . 10.0 108.762 178.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -79.41 3.82 17.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.973 -1.012 . . . . 10.0 111.209 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' C' ' 447' ' ' GLU . 44.9 mmtt -112.39 -45.45 3.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.255 -0.276 . . . . 10.0 110.255 179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 85.7 t -64.32 -38.93 83.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -56.15 -61.0 7.31 Favored Pre-proline 0 CA--C 1.539 0.541 0 O-C-N 123.092 0.245 . . . . 10.0 111.31 179.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 39.4 Cg_endo -67.94 -29.8 33.84 Favored 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 121.735 1.623 . . . . 10.0 112.175 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 10.8 t80 -63.67 -48.99 74.94 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 109.098 -0.704 . . . . 10.0 109.098 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 8.1 mt -67.24 -37.2 83.14 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.69 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 6.8 t70 -61.45 -48.95 78.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.574 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -65.41 -41.71 93.34 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.171 179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.468 ' HD2' ' CZ2' ' C' ' 463' ' ' TRP . 1.8 m-85 -64.85 -42.98 94.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.44 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -61.14 -39.18 89.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.451 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 73.4 mttt -65.11 -41.77 94.61 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.468 ' HB3' H281 ' C' ' 602' ' ' PCW . 0.2 OUTLIER -65.34 -41.84 93.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.793 -0.64 . . . . 10.0 109.753 178.688 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.585 ' CD1' ' H75' ' C' ' 629' ' ' 17F . 39.8 m0 -65.41 -36.78 84.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.78 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -64.7 -46.44 82.33 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.62 ' HB2' ' HE1' ' A' ' 312' ' ' HIS . 47.4 mt-10 -58.58 -47.43 84.31 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.088 -0.708 . . . . 10.0 109.088 178.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.435 ' OE2' H262 ' C' ' 602' ' ' PCW . 0.3 OUTLIER -59.3 -48.18 82.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.384 -0.825 . . . . 10.0 110.654 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 52.8 mtm -61.98 -43.36 99.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.354 -0.384 . . . . 10.0 110.73 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -64.74 -43.12 94.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.952 -0.567 . . . . 10.0 109.688 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.609 HD21 ' HG3' ' A' ' 308' ' ' ARG . 68.9 mt -61.84 -38.75 89.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.845 178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -63.11 -38.71 92.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.217 0.532 . . . . 10.0 110.0 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -76.74 -3.74 39.72 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.23 0.538 . . . . 10.0 110.138 178.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -121.88 10.83 10.27 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.822 -0.626 . . . . 10.0 110.191 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.484 ' HE2' HD22 ' C' ' 469' ' ' LEU . 2.0 mttp -143.16 -62.2 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.554 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 50.9 t -65.43 -37.29 79.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 109.491 -0.559 . . . . 10.0 109.491 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.68 -61.7 5.81 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 115.932 -0.576 . . . . 10.0 111.273 178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -64.46 -37.43 38.8 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 121.724 1.616 . . . . 10.0 111.506 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.62 -32.19 73.16 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.576 0.227 . . . . 10.0 111.004 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -67.98 -34.73 77.11 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.766 -0.828 . . . . 10.0 108.766 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -69.84 -40.02 76.07 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 108.472 -0.936 . . . . 10.0 108.472 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.7 -37.12 86.52 Favored 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 177.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 22.6 mt -72.12 -36.16 69.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.478 -0.783 . . . . 10.0 110.069 178.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -62.45 -59.26 5.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.08 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.36 -37.13 80.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.777 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.97 -43.98 98.43 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.343 -0.703 . . . . 10.0 111.343 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' C' ' 489' ' ' LEU . . . -69.44 -40.29 77.31 Favored 'General case' 0 C--O 1.218 -0.574 0 N-CA-C 109.399 -0.593 . . . . 10.0 109.399 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.09 -44.22 91.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.81 0.338 . . . . 10.0 110.412 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.438 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 17.1 mm-40 -67.64 -41.08 84.43 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.065 -0.516 . . . . 10.0 109.642 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.47 -40.12 95.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 121.112 0.482 . . . . 10.0 109.942 178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' C' ' 485' ' ' ALA . 68.0 mt -66.31 -35.89 81.54 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.708 -0.678 . . . . 10.0 109.254 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -41.06 86.18 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -58.44 -40.41 82.51 Favored 'General case' 0 CA--C 1.524 -0.051 0 N-CA-C 108.455 -0.943 . . . . 10.0 108.455 177.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.0 -40.16 75.43 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 114.995 -1.002 . . . . 10.0 110.479 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -61.82 -35.25 77.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.769 0.319 . . . . 10.0 110.535 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -72.61 0.8 9.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.51 -0.768 . . . . 10.0 110.558 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.582 ' HE3' HD22 ' A' ' 279' ' ' LEU . 36.9 mttp -120.49 -43.15 2.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.923 -0.581 . . . . 10.0 109.988 178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.504 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 83.2 mt -62.41 -24.35 67.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.687 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.565 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 3.8 m -83.02 -64.74 0.24 Allowed Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 120.86 -0.336 . . . . 10.0 111.762 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 41.7 Cg_endo -68.02 -56.15 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.464 1.442 . . . . 10.0 112.203 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 279' ' ' LEU . 83.4 mt -66.24 -29.9 70.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.596 0.236 . . . . 10.0 110.423 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.504 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.71 -54.98 27.57 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.931 -0.867 . . . . 10.0 110.931 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -66.83 -32.16 73.26 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.64 -0.504 . . . . 10.0 109.64 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 28.4 tt0 -62.98 -43.66 98.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.746 -0.661 . . . . 10.0 109.244 178.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.623 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 50.8 mmm -64.56 -33.14 75.2 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.042 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . 0.509 ' O ' ' HG3' ' C' ' 508' ' ' ARG . 98.8 mtt180 -69.58 -41.89 75.2 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -64.86 -37.06 86.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 10.0 109.337 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.623 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 46.3 mtt180 -64.15 -44.72 91.29 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 108.474 -0.936 . . . . 10.0 108.474 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.75 88.71 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.475 -0.784 . . . . 10.0 109.983 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 89.9 mtt180 -60.89 -42.36 97.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 10.0 109.831 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . . . . . . . . . . . -63.84 -36.99 85.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.659 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.529 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 62.6 m-70 -75.42 -49.44 18.92 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.886 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 69.1 t -62.91 -41.25 92.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.332 -0.395 . . . . 10.0 111.04 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.668 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 23.4 t0 -63.65 -36.89 85.32 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.579 -0.526 . . . . 10.0 109.579 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . 0.52 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -68.01 -41.17 82.6 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.614 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 94.9 mt -60.1 -28.26 67.69 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.89 -0.595 . . . . 10.0 110.819 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 86.3 mtt180 -66.26 -33.07 74.92 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.39 -0.596 . . . . 10.0 109.39 178.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.39 9.84 39.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.443 0.64 . . . . 10.0 110.387 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.614 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 7.4 m170 -117.78 -58.6 2.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.545 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.52 -51.87 11.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 112.007 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.664 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.77 -57.32 18.03 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 112.957 0.725 . . . . 10.0 112.957 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.664 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.6 Cg_exo -59.03 -41.84 57.39 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 121.965 1.777 . . . . 10.0 110.892 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -64.52 -33.52 76.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 56.3 m -66.38 -34.37 77.81 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.576 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 0.4 OUTLIER -71.76 -39.76 69.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 178.456 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -63.06 -41.02 99.37 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 108.588 -0.893 . . . . 10.0 108.588 177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.448 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 26.3 mt -62.67 -37.74 87.6 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.196 -0.911 . . . . 10.0 109.959 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 90.0 mtt180 -56.01 -41.98 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.489 -0.323 . . . . 10.0 111.099 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -66.59 -43.16 85.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.242 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.653 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.3 mtt180 -66.74 -46.68 74.66 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.022 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 58.3 mt -62.85 -31.52 72.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.287 179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.33 -40.43 97.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -76.96 -36.14 56.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.754 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -64.34 -48.62 74.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.739 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.437 HD23 HD12 ' C' ' 536' ' ' LEU . 87.6 mt -68.08 -31.69 71.49 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.67 -0.696 . . . . 10.0 109.655 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.403 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 28.0 tt0 -64.81 -42.53 94.93 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.19 93.03 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.841 -0.8 . . . . 10.0 108.841 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.437 HD12 HD23 ' C' ' 533' ' ' LEU . 95.4 mt -66.73 -29.37 69.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.657 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 54.6 mtmt -83.5 -44.97 14.12 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.844 0.354 . . . . 10.0 110.72 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -63.46 -56.25 17.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.829 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -72.47 -23.15 61.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.931 -0.766 . . . . 10.0 108.931 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.424 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.74 -48.31 56.39 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.277 -1.129 . . . . 10.0 110.277 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -62.63 -38.81 97.04 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.809 -0.916 . . . . 10.0 110.809 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -65.32 -46.21 81.22 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -62.9 -38.07 89.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.953 178.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 31.9 mt -60.92 -38.5 86.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.915 -0.402 . . . . 10.0 109.915 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -67.48 -40.98 85.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.01 -40.41 83.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.644 -0.707 . . . . 10.0 110.435 179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -65.78 -37.67 86.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.032 178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -70.87 -39.73 72.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.703 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -64.33 -46.19 84.59 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -27.58 68.05 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.985 178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -63.99 -48.9 74.57 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.933 -0.395 . . . . 10.0 109.933 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -37.41 84.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 10.0 110.158 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -65.47 -39.99 92.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.355 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -72.11 -36.43 69.45 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.583 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 2.6 mp -64.2 -40.8 96.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.503 179.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.62 -36.88 79.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.931 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.71 -35.77 65.15 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 120.769 0.319 . . . . 10.0 110.222 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 21.3 mt -60.41 -50.97 71.48 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.097 -0.501 . . . . 10.0 109.799 178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.0 p -69.86 -38.09 76.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.222 -0.445 . . . . 10.0 110.909 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -56.19 -39.78 72.94 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.214 179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.601 ' HA ' ' HE3' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -86.1 -37.38 18.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.781 -0.645 . . . . 10.0 111.078 179.362 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.24 91.99 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.797 0.665 . . . . 10.0 112.797 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.545 ' HB2' ' HD3' ' C' ' 564' ' ' PRO . 99.0 mttt -50.75 -62.49 2.7 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 112.679 0.622 . . . . 10.0 112.679 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.545 ' HD3' ' HB2' ' C' ' 563' ' ' LYS . 56.6 Cg_endo -72.96 -35.14 5.7 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 121.896 1.731 . . . . 10.0 112.872 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.45 -51.44 63.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.471 0.174 . . . . 10.0 111.471 -179.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.64 -43.86 97.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.896 0.379 . . . . 10.0 110.493 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -63.98 -45.68 87.98 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.3 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -64.56 -35.57 81.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 120.724 0.297 . . . . 10.0 110.721 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.97 -45.04 83.13 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -66.37 -49.95 65.13 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.879 0.371 . . . . 10.0 110.567 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -68.08 -16.02 63.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.246 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -93.57 -37.45 5.55 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 111.218 -0.753 . . . . 10.0 111.218 179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.458 ' HA ' ' HB ' ' C' ' 576' ' ' VAL . 49.1 mt -76.56 -28.5 56.28 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.832 0.308 . . . . 10.0 111.832 -179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 38.5 mt -53.45 -58.83 11.18 Favored Pre-proline 0 N--CA 1.469 0.506 0 N-CA-C 111.911 0.338 . . . . 10.0 111.911 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.59 -31.0 34.34 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 121.753 1.636 . . . . 10.0 110.637 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.458 ' HB ' ' HA ' ' C' ' 573' ' ' LEU . 3.6 t -64.06 -42.47 95.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.429 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.0 mt -61.31 -42.67 99.05 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.89 -41.08 95.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.376 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 12.9 m -65.77 -44.53 85.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.885 -0.598 . . . . 10.0 109.585 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.29 -37.25 86.52 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.88 -0.6 . . . . 10.0 111.248 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -56.68 -45.43 81.76 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 123.193 0.308 . . . . 10.0 110.305 179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 48.6 t -63.4 -44.39 98.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.13 -0.487 . . . . 10.0 109.977 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 6.1 m -62.23 -43.19 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.87 -0.605 . . . . 10.0 110.724 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -68.76 -47.61 65.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.886 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 49.0 mt -57.27 -50.81 71.72 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 116.41 -0.359 . . . . 10.0 111.518 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 16.8 p -62.28 -34.61 76.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.914 0.388 . . . . 10.0 111.032 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.751 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -69.09 -53.29 21.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.276 -0.42 . . . . 10.0 109.994 178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 91.0 mt -56.31 -47.44 78.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 10.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -59.81 -51.08 71.28 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.754 0.279 . . . . 10.0 111.754 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -64.82 -35.24 80.47 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.973 -0.291 . . . . 10.0 110.809 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -62.02 -41.75 98.41 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' C' ' 596' ' ' ASN . 9.6 m -61.13 -31.84 71.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.786 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -78.92 -36.75 41.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.996 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.504 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.7 mptt -74.94 -34.63 62.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.809 0.338 . . . . 10.0 111.017 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 26.2 mt -96.9 32.6 2.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 10.0 111.244 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' C' ' 592' ' ' THR . 13.4 t-20 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.42 -0.355 . . . . 10.0 110.728 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' B' ' 50' ' ' THR . 16.7 ptp . . . . . 0 C--O 1.234 0.251 0 CA-C-O 120.954 0.407 . . . . 10.0 111.152 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.44 123.4 28.55 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.956 -0.566 . . . . 10.0 110.846 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.432 ' HG3' HD23 ' B' ' 52' ' ' LEU . 2.5 tt0 -91.44 139.02 31.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.671 0.272 . . . . 10.0 111.399 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -131.44 134.17 45.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.035 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 58.5 mmtt -91.66 113.21 25.42 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.896 0.379 . . . . 10.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 63.5 mt -113.29 125.2 54.03 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.141 0.496 . . . . 10.0 111.473 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.6 t -121.42 121.75 65.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 109.284 -0.635 . . . . 10.0 109.284 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.748 HG12 ' HB2' ' B' ' 79' ' ' LEU . 2.7 m -97.87 138.15 23.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.389 . . . . 10.0 111.252 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.493 HG21 HD11 ' B' ' 100' ' ' ILE . 15.4 m -127.32 151.58 34.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.232 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.53 174.03 38.88 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.82 -0.705 . . . . 10.0 111.718 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.77 163.32 16.54 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.773 0.321 . . . . 10.0 110.744 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.11 118.69 6.05 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.492 -0.861 . . . . 10.0 111.328 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 114.6 -2.74 23.32 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.314 -179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.598 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 16.3 m -81.3 -12.86 12.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.566 0.58 . . . . 10.0 112.566 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.7 35.04 23.41 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.577 -0.821 . . . . 10.0 112.263 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.413 ' NZ ' ' O1G' ' B' ' 216' ' ' GNP . 21.2 ttpp -65.66 -44.93 84.8 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 122.325 0.25 . . . . 10.0 111.509 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 55.3 m -68.2 -36.99 80.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.875 0.369 . . . . 10.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.52 92.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.756 -0.656 . . . . 10.0 110.779 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 16.6 mt -59.39 -42.16 91.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.17 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -66.14 -50.47 63.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 10.0 111.484 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.488 HD13 ' CG1' ' D' ' 388' ' ' VAL . 22.8 mt -62.27 -40.11 86.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 121.052 0.453 . . . . 10.0 110.992 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.536 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 20.1 tp60 -67.19 -18.68 65.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.988 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 27.9 tp -98.21 -40.75 8.22 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.869 0.366 . . . . 10.0 111.575 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.464 HG23 ' HD3' ' B' ' 42' ' ' LYS . 35.5 mm -80.86 -66.31 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.495 HE21 ' HE2' ' B' ' 40' ' ' TYR . 71.7 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.118 -0.492 . . . . 10.0 111.126 -179.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 m-20 69.51 33.69 3.03 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 123.7 0.625 . . . . 10.0 110.256 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -122.35 155.85 35.15 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.992 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -112.71 153.41 27.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.601 0.715 . . . . 10.0 112.098 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 12.6 m -109.0 173.83 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -143.83 -26.76 0.54 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.475 0.655 . . . . 10.0 109.903 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.449 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 1.3 pm0 -96.26 129.44 43.58 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.588 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.445 ' CD1' H5'1 ' B' ' 216' ' ' GNP . 54.5 t80 -82.11 125.05 30.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.897 0.38 . . . . 10.0 110.262 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.437 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 0.3 OUTLIER -135.97 128.14 17.52 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.865 -0.607 . . . . 10.0 109.829 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 24.5 Cg_exo -63.68 124.66 14.04 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.612 2.208 . . . . 10.0 112.295 -179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.45 144.16 34.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.679 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 38.3 mt -117.77 -51.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.089 0.403 . . . . 10.0 112.089 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.749 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 31.3 tt0 -145.29 107.64 4.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.573 0.225 . . . . 10.0 111.34 -178.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 40.8 t0 -128.49 126.82 41.23 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.452 -0.203 . . . . 10.0 110.452 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 67.5 m -112.04 113.87 26.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.955 0.407 . . . . 10.0 111.61 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.495 ' HE2' HE21 ' B' ' 25' ' ' GLN . 1.2 m-85 -109.5 134.33 52.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.003 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -132.76 131.1 40.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.852 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.464 ' HD3' HG23 ' B' ' 24' ' ' ILE . 20.8 ttpt -144.3 135.73 25.65 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.121 -0.326 . . . . 10.0 110.121 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.621 ' O ' ' HA3' ' D' ' 469' ' ' GLY . 0.6 OUTLIER -84.22 89.47 7.33 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.929 0.395 . . . . 10.0 110.154 179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 4.1 m -103.76 153.18 6.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.718 0.294 . . . . 10.0 111.695 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 26.5 t -102.14 111.5 32.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 109.875 -0.417 . . . . 10.0 109.875 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 47.5 mt -111.12 122.0 64.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.46 -0.336 . . . . 10.0 111.321 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 74.52 -52.62 0.68 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.778 0.831 . . . . 10.0 112.881 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.539 ' HA2' ' HA ' ' D' ' 450' ' ' ALA . . . -170.71 -35.09 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.879 -0.677 . . . . 10.0 112.036 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 20.5 pt-20 -98.99 164.5 12.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.619 0.247 . . . . 10.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.629 ' O ' ' HA ' ' B' ' 1' ' ' MET . 26.1 m -82.71 128.39 34.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.395 -0.594 . . . . 10.0 109.395 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 78.1 m -114.44 137.66 51.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.995 0.426 . . . . 10.0 110.83 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.432 HD23 ' HG3' ' B' ' 3' ' ' GLU . 13.7 tp -102.47 98.78 8.81 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 10.0 110.318 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 87.3 mt -88.71 113.3 24.12 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.112 -0.495 . . . . 10.0 111.108 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -98.13 99.7 10.96 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.639 -0.874 . . . . 10.0 108.639 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.3 mt -92.13 128.95 43.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.096 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 61.3 tp -112.98 110.48 20.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.534 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 31.0 t0 -86.3 118.13 25.55 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.82 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 40.5 p -95.4 -177.9 4.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.347 0.499 . . . . 10.0 112.347 -178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.679 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -94.76 139.72 30.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.782 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -98.84 -12.54 43.16 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 111.515 -0.634 . . . . 10.0 111.515 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -111.26 35.22 3.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.852 0.358 . . . . 10.0 110.33 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.458 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 32.1 tt0 -131.62 137.91 48.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.081 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -85.93 -173.97 4.87 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.063 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . 0.425 ' HE1' ' HB2' ' B' ' 69' ' ' ASP . 20.4 t80 -62.76 114.19 3.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.403 0.621 . . . . 10.0 112.115 -179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 12.9 m -125.71 159.07 33.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.157 -0.928 . . . . 10.0 109.491 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.62 -43.17 89.58 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.001 0.371 . . . . 10.0 112.001 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 79.5 mmm -62.28 -39.01 91.53 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.833 0.349 . . . . 10.0 111.08 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.535 ' HA ' ' CE1' ' B' ' 71' ' ' TYR . 18.8 ttm-85 -63.46 -35.67 81.22 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.22 0.533 . . . . 10.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.425 ' HB2' ' HE1' ' B' ' 64' ' ' TYR . 17.5 t70 -75.38 -11.4 60.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.57 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.9 tt0 -91.23 -67.34 0.86 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 112.324 0.49 . . . . 10.0 112.324 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' B' ' 68' ' ' ARG . 2.5 p90 -64.43 -25.39 67.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.947 1.091 . . . . 10.0 113.947 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 23.3 ttp -79.3 -7.46 58.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.09 0.472 . . . . 10.0 110.478 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' B' ' 73' ' ' ARG . 26.8 ttm105 -89.87 -31.75 17.18 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.339 179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.2 m -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.685 -0.689 . . . . 10.0 111.717 -179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.52 153.26 46.79 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.915 -0.66 . . . . 10.0 113.308 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -108.16 -57.12 2.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.192 0.52 . . . . 10.0 110.141 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.441 ' HA3' HD11 ' B' ' 163' ' ' ILE . . . -98.75 129.99 10.08 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.379 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.487 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 63.7 m-85 -118.37 119.7 35.41 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.485 0.66 . . . . 10.0 111.801 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.748 ' HB2' HG12 ' B' ' 8' ' ' VAL . 46.4 mt -100.45 121.0 40.83 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.425 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 22.3 m -99.52 97.19 8.22 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.356 -0.609 . . . . 10.0 109.356 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.626 HG12 ' HB ' ' B' ' 114' ' ' VAL . 13.4 m -100.0 135.78 34.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.411 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.587 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 15.2 p90 -141.22 152.95 45.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.483 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -83.8 120.42 26.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.98 -0.555 . . . . 10.0 109.594 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.505 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.4 pp -73.48 -9.24 12.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.478 0.547 . . . . 10.0 112.478 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.544 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 22.5 p-10 -90.85 9.69 29.26 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.228 0.537 . . . . 10.0 110.181 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.474 HD21 ' HB3' ' B' ' 88' ' ' LYS . 37.5 t30 -142.16 121.93 13.49 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.32 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.12 -29.14 66.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.519 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' B' ' 86' ' ' ASN . 27.1 tptp -60.41 -45.53 93.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.476 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.587 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -62.53 -34.97 77.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.924 0.342 . . . . 10.0 111.924 -179.464 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -62.98 -39.96 96.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.109 0.48 . . . . 10.0 111.321 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -87.15 -18.25 30.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.11 -0.495 . . . . 10.0 111.44 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -76.66 -25.9 54.24 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.861 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 89' ' ' SER . 19.3 mm -56.16 -39.15 57.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.001 -0.545 . . . . 10.0 111.599 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 30.4 t60 -57.37 -35.32 69.82 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.775 0.321 . . . . 10.0 111.036 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -62.69 -46.74 86.76 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.041 0.448 . . . . 10.0 110.131 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' B' ' 93' ' ' ILE . 63.3 m-85 -67.53 -38.14 83.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.68 -0.691 . . . . 10.0 110.673 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 64.4 ttt-85 -60.07 -51.23 70.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.755 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' B' ' 94' ' ' HIS . 11.6 mm-40 -63.08 -31.57 72.74 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.007 -0.542 . . . . 10.0 110.525 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.451 ' O ' HG23 ' B' ' 103' ' ' VAL . 3.4 mt-30 -64.94 -49.68 69.41 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.841 -0.429 . . . . 10.0 109.841 178.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.493 HD11 HG21 ' B' ' 9' ' ' VAL . 87.6 mt -58.49 -45.02 90.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.788 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -56.95 -41.01 77.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.983 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.0 ttp85 -70.64 -46.2 63.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.885 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 99' ' ' GLN . 93.2 t -61.26 -48.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 10.0 111.31 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.453 ' HD3' ' HZ ' ' B' ' 78' ' ' PHE . 32.6 mmmt -73.65 -14.49 61.17 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 111.836 0.31 . . . . 10.0 111.836 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 62.69 30.67 16.88 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.775 0.672 . . . . 10.0 110.773 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 49.7 m -155.8 143.56 19.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 10.0 109.684 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.16 -38.55 17.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.733 0.302 . . . . 10.0 111.696 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -85.35 86.03 7.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.044 0.449 . . . . 10.0 111.333 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.1 m -126.66 152.68 75.1 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.685 -0.689 . . . . 10.0 110.118 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -65.73 95.54 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.385 0 C-N-CA 122.753 2.302 . . . . 10.0 112.812 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.487 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 69.2 mtm -125.91 135.56 52.03 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.873 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.478 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.4 t -130.05 129.98 65.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.525 -0.307 . . . . 10.0 110.461 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 93' ' ' ILE . 35.1 tp -91.04 125.04 35.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.792 -0.447 . . . . 10.0 109.792 179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.626 ' HB ' HG12 ' B' ' 81' ' ' VAL . 1.3 t -125.86 125.83 68.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.062 0.458 . . . . 10.0 110.788 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.28 126.3 8.46 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.543 -0.837 . . . . 10.0 111.294 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.691 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 65.1 t30 -105.54 162.46 13.46 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 110.421 -0.214 . . . . 10.0 110.421 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.405 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.9 mttt 66.32 30.36 9.02 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.707 0.629 . . . . 10.0 112.348 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . . . . . . . . . 40.0 m -74.51 -12.75 60.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.182 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.72 -29.37 62.22 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.106 -0.952 . . . . 10.0 109.898 179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.458 HD21 HN21 ' B' ' 216' ' ' GNP . 85.3 mt -70.85 139.91 86.01 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.402 -0.817 . . . . 10.0 111.515 -179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -68.11 -15.79 43.58 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 123.039 2.493 . . . . 10.0 112.286 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.72 48.52 0.95 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.115 0.483 . . . . 10.0 110.996 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.505 ' HG3' HD13 ' B' ' 84' ' ' ILE . 15.5 ttm180 -71.65 89.4 1.0 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.756 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 1.3 m -77.46 -51.27 11.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.76 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 43.4 t -76.69 120.69 27.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.737 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.799 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 19.5 t70 -74.34 151.19 39.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.074 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.457 ' OG1' ' H73' ' C' ' 601' ' ' PCW . 0.0 OUTLIER -60.97 -44.19 97.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.377 -179.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -67.52 -33.16 74.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.663 0.268 . . . . 10.0 110.754 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.799 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 43.0 mt-30 -57.64 -34.63 69.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.024 0.44 . . . . 10.0 110.867 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -92.54 -41.79 10.05 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.021 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.56 ' OE1' ' H51' ' C' ' 602' ' ' PCW . 50.4 mt-30 -65.51 -42.01 92.56 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 -179.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -65.31 -44.44 87.84 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.521 -0.548 . . . . 10.0 109.521 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.9 -42.82 97.35 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.343 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' B' ' 139' ' ' ILE . . . -58.4 -40.55 82.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.422 -0.808 . . . . 10.0 111.426 179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.512 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 3.0 tpt85 -67.7 -33.92 75.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.966 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 13.5 m -67.8 -33.17 74.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 10.0 111.063 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -91.3 -15.73 28.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.523 -0.308 . . . . 10.0 111.492 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.46 41.82 19.68 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.928 -0.653 . . . . 10.0 112.345 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.471 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 6.8 pt -129.21 142.05 43.86 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 120.563 0.221 . . . . 10.0 111.149 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 14.8 Cg_exo -70.85 145.28 50.44 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 123.378 2.718 . . . . 10.0 112.364 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -132.76 135.94 46.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.185 -0.461 . . . . 10.0 110.058 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 8.7 mm -144.13 145.28 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 120.622 0.249 . . . . 10.0 111.203 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -84.22 125.3 32.08 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.72 -0.844 . . . . 10.0 108.72 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.47 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 54.0 m -152.81 114.82 4.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.876 0.37 . . . . 10.0 111.644 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . 0.691 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 1.6 m -110.48 141.71 43.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.129 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -72.39 -31.46 65.57 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.236 0.541 . . . . 10.0 110.376 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.4 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 56.8 tttm -62.94 -42.47 99.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.48 -0.782 . . . . 10.0 110.802 179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.05 -35.85 31.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.157 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.536 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.0 OUTLIER 67.37 21.75 9.67 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.145 0.497 . . . . 10.0 112.18 179.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -108.76 131.76 54.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.855 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 90.0 -12.42 67.67 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.984 -0.553 . . . . 10.0 112.777 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . 0.407 HG22 ' CG2' ' B' ' 144' ' ' THR . 3.0 t -60.26 -45.67 95.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.86 0.362 . . . . 10.0 111.583 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -57.46 -58.87 6.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.359 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.82 -32.91 72.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.361 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.46 -41.98 86.43 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.136 0.493 . . . . 10.0 110.654 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . 0.435 ' O ' HG23 ' B' ' 160' ' ' VAL . 20.0 m-85 -74.59 -41.08 61.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.554 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -62.73 -38.95 92.49 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.19 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.567 ' HA ' ' HD2' ' B' ' 161' ' ' ARG . 30.7 m -63.02 -38.18 90.16 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.366 -0.379 . . . . 10.0 110.816 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.562 HD22 ' HG ' ' B' ' 79' ' ' LEU . 51.9 tp -60.46 -43.57 96.75 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.009 -0.541 . . . . 10.0 109.69 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.435 HG23 ' O ' ' B' ' 156' ' ' PHE . 22.3 t -62.68 -41.87 93.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 115.78 -0.646 . . . . 10.0 109.982 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' B' ' 158' ' ' THR . 66.9 mtt180 -62.49 -43.49 98.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.881 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -64.17 -38.08 89.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.718 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.538 HG22 ' HE2' ' B' ' 167' ' ' LYS . 82.7 mt -64.08 -42.51 95.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.186 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' B' ' 164' ' ' ARG . 50.2 mtt180 -58.66 -43.86 89.97 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.079 -0.51 . . . . 10.0 110.292 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.58 ' HD3' ' O2P' ' B' ' 206' ' ' PCW . 52.5 mtmt -69.64 -30.7 68.47 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.862 -0.608 . . . . 10.0 111.0 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -66.03 -41.11 91.34 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.297 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.538 ' HE2' HG22 ' B' ' 163' ' ' ILE . 63.6 mttm -62.01 -35.95 80.09 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.862 -0.608 . . . . 10.0 109.692 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.504 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 41.2 tt0 -76.5 -36.8 57.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.814 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 27.7 ttpt -60.18 -34.92 74.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.418 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 37.5 mmt -65.11 -33.97 77.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.464 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -41.8 46.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.236 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.504 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 56.5 mtmt -71.63 -35.65 70.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.703 -179.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -81.23 -52.72 7.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.065 0.459 . . . . 10.0 110.998 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 78.52 -108.09 2.59 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 110.827 -0.909 . . . . 10.0 110.827 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.474 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 26.9 mmtm -136.06 22.96 3.28 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.184 0.516 . . . . 10.0 109.626 178.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.533 ' HB3' ' H ' ' B' ' 177' ' ' LYS . 13.7 tptt -108.18 -120.7 0.25 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.476 -179.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . 0.533 ' H ' ' HB3' ' B' ' 176' ' ' LYS . 2.8 ptmm? -159.54 89.93 0.92 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.07 0.462 . . . . 10.0 111.547 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -112.73 -3.59 14.21 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.003 -0.74 . . . . 10.0 109.003 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' B' ' 179' ' ' LYS . 17.5 pttt -92.96 101.11 13.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.9 -1.046 . . . . 10.0 110.606 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 16.4 tttm -151.3 33.1 0.58 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.226 0.536 . . . . 10.0 110.885 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . 0.488 ' HB3' ' O1P' ' B' ' 207' ' ' PCW . 3.6 m -84.01 56.73 3.83 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.639 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' B' ' 135' ' ' ARG . 55.6 tttm -154.21 93.97 1.67 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.579 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 9.8 t -141.14 -40.27 0.4 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.59 -0.277 . . . . 10.0 111.541 178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -169.68 81.16 0.12 Allowed 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.145 0.498 . . . . 10.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--N 1.319 -0.749 0 CA-C-N 116.295 -0.411 . . . . 10.0 110.465 179.387 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 62.8 t30 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.447 0.641 . . . . 10.0 110.314 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.02 127.02 33.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.106 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' D' ' 369' ' ' VAL . 5.4 tp -120.76 115.18 46.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.175 0.512 . . . . 10.0 110.664 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.715 ' HG2' HG22 ' D' ' 369' ' ' VAL . 11.5 mtt85 -90.69 97.29 11.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.043 0.449 . . . . 10.0 111.401 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 11.4 t -92.76 125.45 45.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.947 -0.569 . . . . 10.0 109.645 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -106.93 131.36 54.1 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.168 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.966 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.3 mp -101.64 174.06 3.16 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.218 -0.901 . . . . 10.0 108.841 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.825 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.2 Cg_endo -53.07 158.26 7.07 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.693 2.262 . . . . 10.0 113.159 179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 63.4 t30 70.58 -91.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.345 -0.843 . . . . 10.0 111.59 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . 0.412 ' HB3' ' HE2' ' D' ' 365' ' ' LYS . 17.9 ptpt -156.0 26.6 0.37 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.41 0.624 . . . . 10.0 110.288 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.966 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 1.0 OUTLIER -83.33 144.05 29.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 110.127 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 12.9 ptt85 -151.56 138.86 19.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.686 0.279 . . . . 10.0 110.923 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 7.9 m -142.66 115.25 8.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.421 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.749 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 22.9 t -92.73 113.13 27.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 108.948 -0.76 . . . . 10.0 108.948 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.33 -176.57 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.255 -0.429 . . . . 10.0 110.662 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.518 ' HB2' HD11 ' B' ' 36' ' ' ILE . 22.2 t-20 -140.2 103.35 4.58 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.973 0.416 . . . . 10.0 110.922 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.2 m -80.08 -179.48 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 10.0 111.268 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -162.57 140.65 8.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.55 0.214 . . . . 10.0 110.606 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 73.59 -76.92 0.06 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.647 -0.706 . . . . 10.0 112.758 178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -165.1 115.96 0.67 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.882 -0.675 . . . . 10.0 111.921 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 40.2 mtt -142.93 137.83 29.72 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 110.267 -0.271 . . . . 10.0 110.267 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.35 165.74 12.05 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 426' ' ' LEU . 68.7 mt -54.11 -44.97 71.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.063 0.459 . . . . 10.0 110.127 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -57.24 -36.12 70.54 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.499 -0.773 . . . . 10.0 112.017 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -62.13 -59.9 4.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.195 0.521 . . . . 10.0 111.252 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 2.7 m -64.76 -36.5 84.52 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.603 -0.726 . . . . 10.0 111.725 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.501 HD21 HG21 ' D' ' 428' ' ' VAL . 0.2 OUTLIER -64.11 -29.29 70.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.901 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 24.8 ttp -71.57 -30.91 66.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.343 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -66.58 -42.86 86.35 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.05 -0.523 . . . . 10.0 110.353 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -77.98 -23.55 48.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.172 0.51 . . . . 10.0 110.295 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . 0.477 HD21 ' HD3' ' D' ' 393' ' ' PRO . 18.1 tp -61.02 -38.39 85.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.486 -0.779 . . . . 10.0 111.994 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -74.98 -20.3 59.72 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.766 0.317 . . . . 10.0 111.405 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.488 ' CG1' HD13 ' B' ' 21' ' ' ILE . 54.8 t -83.52 -45.61 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 121.068 0.461 . . . . 10.0 110.135 179.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 8.4 mmt180 -78.87 -30.62 45.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.871 -0.604 . . . . 10.0 112.318 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 69.94 40.39 73.95 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.821 -0.704 . . . . 10.0 111.55 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.3 mt -107.02 -173.44 2.29 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.611 0.244 . . . . 10.0 110.763 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -120.74 126.66 26.6 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.962 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . 0.477 ' HD3' HD21 ' D' ' 386' ' ' LEU . 38.1 Cg_endo -67.23 -11.89 33.89 Favored 'Trans proline' 0 N--CA 1.474 0.342 0 C-N-CA 122.962 2.442 . . . . 10.0 112.642 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -69.14 -35.0 75.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.414 . . . . 10.0 111.322 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . 0.521 ' HA ' HD11 ' D' ' 431' ' ' LEU . 22.3 m -96.13 1.26 52.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.053 -179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 65.3 m -100.88 137.5 39.18 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.006 -0.543 . . . . 10.0 110.871 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 134.53 52.04 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.068 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.0 m -87.18 110.24 20.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.147 0.425 . . . . 10.0 112.147 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.422 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 67.3 m-85 -110.69 128.34 55.67 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.075 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.492 ' HD2' HD21 ' D' ' 412' ' ' LEU . 10.3 ptm180 -86.61 175.69 8.17 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.634 -0.257 . . . . 10.0 110.782 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 28.5 tp -64.69 142.2 58.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.309 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' D' ' 409' ' ' LYS . 27.0 mt -73.49 118.31 16.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.878 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -115.5 96.65 5.74 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.984 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 59.18 44.57 15.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.433 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.535 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 16.9 t-80 -104.88 160.64 14.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.914 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . 0.412 ' HE2' ' HB3' ' D' ' 406' ' ' LYS . 12.5 mtpt -64.76 -34.41 78.26 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.023 0.439 . . . . 10.0 109.911 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 147.1 28.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.501 -0.857 . . . . 10.0 112.733 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.535 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.6 ttpp -118.48 134.53 55.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.655 0.264 . . . . 10.0 110.535 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.619 ' HA ' HD21 ' D' ' 402' ' ' LEU . 68.5 mttt -58.55 136.41 57.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.38 179.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -102.33 114.51 28.75 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -77.58 139.87 39.6 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.527 0.566 . . . . 10.0 112.527 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.492 HD21 ' HD2' ' D' ' 400' ' ' ARG . 15.9 mt -113.47 -168.83 1.39 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.094 -0.503 . . . . 10.0 109.734 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -100.0 155.33 17.76 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.773 -0.455 . . . . 10.0 109.773 178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -72.25 -27.49 62.53 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.111 0.481 . . . . 10.0 110.784 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -93.71 54.96 2.08 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.459 0.647 . . . . 10.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 18.3 m -114.08 134.78 54.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.556 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -65.66 128.78 37.35 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.052 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -74.52 -20.72 59.87 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.758 -0.655 . . . . 10.0 112.221 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -31.09 64.17 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.922 0.392 . . . . 10.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 37.0 m -71.48 -18.75 62.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.162 0.506 . . . . 10.0 110.651 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.1 mp -97.65 20.25 12.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.46 124.38 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.204 0.526 . . . . 10.0 110.05 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 87.49 1.99 82.9 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.505 -0.855 . . . . 10.0 112.354 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -112.5 156.05 23.26 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 110.17 -0.307 . . . . 10.0 110.17 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -106.46 131.73 53.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.358 -0.383 . . . . 10.0 110.506 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.443 HD22 HD22 ' D' ' 378' ' ' LEU . 11.0 tp -113.15 133.21 55.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -115.41 122.5 46.0 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.649 0.262 . . . . 10.0 110.519 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.501 HG21 HD21 ' D' ' 382' ' ' LEU . 5.2 t -102.17 88.43 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 32.9 t0 -96.19 169.88 9.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.179 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 59.1 m-85 -89.36 145.37 25.39 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.625 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' D' ' 395' ' ' CYS . 0.5 OUTLIER -87.34 -141.75 0.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.721 179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' D' ' 431' ' ' LEU . 30.7 t70 -92.05 88.93 6.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.408 -0.36 . . . . 10.0 111.459 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -155.51 -101.98 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.368 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' D' ' 435' ' ' PRO . 61.5 t -120.98 113.07 33.06 Favored Pre-proline 0 C--N 1.332 -0.165 0 N-CA-C 110.28 -0.267 . . . . 10.0 110.28 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' D' ' 434' ' ' VAL . 2.0 Cg_endo -83.15 160.93 15.46 Favored 'Trans proline' 0 C--O 1.238 0.505 0 C-N-CA 123.105 2.537 . . . . 10.0 112.662 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.4 mt 58.76 -155.28 0.35 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.637 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 467' ' ' THR . 0.1 OUTLIER -116.03 161.86 18.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.467 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.75 159.37 15.84 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.883 -0.784 . . . . 10.0 108.883 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -72.64 132.35 43.61 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.751 0.31 . . . . 10.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -95.54 126.7 41.01 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -83.43 85.68 7.2 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.598 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -141.13 96.08 2.94 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.603 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 10.3 ptt-85 -103.22 140.83 36.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.091 0.472 . . . . 10.0 111.337 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.5 -166.29 0.96 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.586 -0.734 . . . . 10.0 109.544 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . 0.511 HG21 ' H63' ' D' ' 501' ' ' PCW . 2.5 p -68.8 169.91 10.53 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.837 0.351 . . . . 10.0 110.403 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . 0.516 ' HD1' ' HA ' ' D' ' 461' ' ' ASN . 1.8 m-85 -102.74 167.62 9.77 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.932 0.396 . . . . 10.0 111.871 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 75.3 mt -70.42 -40.14 74.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.7 -0.682 . . . . 10.0 111.327 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 5.5 mttm -165.26 -173.8 2.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.319 -0.4 . . . . 10.0 110.541 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 16.8 tp -77.01 79.74 3.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.142 0.496 . . . . 10.0 111.386 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . 0.539 ' HA ' ' HA2' ' B' ' 48' ' ' GLY . . . -88.7 153.49 21.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.058 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -113.7 143.34 44.77 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.341 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.2 t -62.06 137.03 58.2 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.66 -19.17 28.07 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.241 0.543 . . . . 10.0 110.102 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 49.2 mm -94.67 -49.25 12.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.87 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.9 m -87.99 -162.29 0.81 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.125 0.488 . . . . 10.0 110.617 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . 0.462 HE22 ' H61' ' D' ' 507' ' ' PCW . 91.6 mt-30 -130.66 27.63 4.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.17 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -120.77 156.87 30.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.518 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -78.59 163.95 25.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.156 179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' D' ' 459' ' ' LEU . 1.0 OUTLIER -106.39 146.41 30.51 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.603 -0.517 . . . . 10.0 109.603 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 1.062 HD11 H381 ' D' ' 509' ' ' PCW . 0.9 OUTLIER -120.6 -64.93 1.2 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.75 0.309 . . . . 10.0 110.743 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.516 ' HA ' ' HD1' ' D' ' 446' ' ' PHE . 5.3 p-10 -157.92 43.04 0.3 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.114 0.483 . . . . 10.0 110.645 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -72.69 -119.65 0.06 OUTLIER Glycine 0 CA--C 1.521 0.447 0 CA-C-N 115.462 -0.79 . . . . 10.0 113.547 -179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . 0.43 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 57.8 m-85 -117.4 144.16 45.25 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.33 0.493 . . . . 10.0 112.33 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -154.85 118.99 4.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.423 -0.808 . . . . 10.0 110.051 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.563 ' HB2' ' H ' ' D' ' 469' ' ' GLY . 69.5 m -63.57 146.84 52.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.189 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -89.44 -54.86 3.9 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.632 -0.258 . . . . 10.0 110.905 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . 0.937 HG21 HG21 ' D' ' 437' ' ' THR . 2.0 m -64.35 -46.49 83.21 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.254 0.55 . . . . 10.0 109.702 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' D' ' 465' ' ' CYS . 0.0 OUTLIER -88.84 -101.69 0.09 Allowed 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . 0.621 ' HA3' ' O ' ' B' ' 43' ' ' GLN . . . 128.76 126.6 2.88 Favored Glycine 0 N--CA 1.44 -1.076 0 C-N-CA 120.923 -0.656 . . . . 10.0 112.3 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -169.52 167.26 9.88 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.676 -0.49 . . . . 10.0 109.676 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 23.0 pttt -115.56 109.83 18.36 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.692 -0.485 . . . . 10.0 109.692 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 18.7 p90 -150.18 159.18 44.62 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.916 0.389 . . . . 10.0 111.572 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 68.1 m80 -93.55 179.85 5.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.894 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . 0.43 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 25.2 mt-10 -72.29 -17.09 61.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.246 0.546 . . . . 10.0 109.775 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -85.14 -36.07 21.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.947 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.645 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.7 m -66.09 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.536 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 10.0 m -54.22 -57.22 11.98 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -2.0 49.39 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -91.2 -47.68 7.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.777 0.288 . . . . 10.0 111.777 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.425 HG22 ' H ' ' D' ' 482' ' ' THR . 9.0 p -64.94 126.34 90.94 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.843 0.312 . . . . 10.0 111.843 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -79.98 -14.76 12.14 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.776 2.317 . . . . 10.0 112.718 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . 0.425 ' H ' HG22 ' D' ' 480' ' ' VAL . 10.8 m -126.0 116.82 22.04 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.897 -0.408 . . . . 10.0 109.897 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 7.3 tpp -83.07 -140.18 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.965 0.412 . . . . 10.0 111.42 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 15.2 m -79.57 31.17 0.24 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.453 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . 0.683 HG12 ' HZ3' ' D' ' 487' ' ' TRP . 3.3 t -82.94 82.41 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.834 -0.621 . . . . 10.0 110.101 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -138.13 138.98 39.19 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.774 -0.648 . . . . 10.0 110.109 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . 0.683 ' HZ3' HG12 ' D' ' 485' ' ' VAL . 48.2 p90 . . . . . 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 10.0 111.559 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.087 H452 H271 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 0.874 H382 H461 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 0.956 ' H61' H371 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.105 H351 H152 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.257 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.956 H371 ' H61' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.105 H152 H351 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.06 H371 ' H31' ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.044 ' H52' H411 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 1.021 ' H70' H281 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.038 H451 H242 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 1.082 H472 H483 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.039 H332 H132 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 1.04 H431 ' C46' ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.05 H432 H211 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.003 H371 H362 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.059 ' H62' ' H2 ' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 1.003 H151 H471 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.094 H483 ' H65' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.094 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.089 H461 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.038 H211 H382 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.04 ' H82' ' H2 ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.125 H181 ' H11' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 0.996 H171 ' C12' ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 1.016 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.087 H271 H452 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.069 H212 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.038 H382 H211 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 0.984 H262 H432 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.06 H221 H251 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.103 ' H39' ' C14' ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.038 H242 H451 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.103 ' C14' ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.06 H442 H222 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.858 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.047 H132 ' H4A' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.038 H331 ' H20' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.063 ' C36' H322 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.04 ' C46' H431 ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.089 H282 H461 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.044 H161 H381 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.094 ' H65' H483 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.118 ' H63' ' H8A' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.934 ' H62' ' H29' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 1.125 ' H11' H181 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 0.966 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.027 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.048 ' H55' H442 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.048 H442 ' H55' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.103 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.018 H212 ' H2 ' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.055 H132 H131 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 0.985 H241 H431 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.092 H211 ' H57' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.06 H251 H221 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.082 H483 H472 ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.941 H182 ' H40' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 0.989 H221 H242 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.06 ' H19' H451 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.066 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.092 ' H57' H211 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 0.907 ' H8 ' H162 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.118 ' H8A' ' H63' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.458 HN21 HD21 ' B' ' 120' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.054 H381 H422 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.045 H442 H483 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.061 H152 ' H39' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.044 H411 ' H52' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.06 H451 ' H19' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.1 H452 H451 ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.069 H331 ' H8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.046 H262 H451 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.062 H381 HD11 ' D' ' 460' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.025 H421 H171 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 0.95 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 0.934 ' H30' ' H39' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.069 ' H8 ' H331 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.015 ' H64' H422 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.094 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.004 H431 H222 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.562 ' HA ' HD12 ' A' ' 204' ' ' LEU . 83.5 mt . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.921 0.391 . . . . 10.0 110.098 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -54.59 -56.74 15.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.178 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 91.0 mt -69.41 -23.48 63.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.796 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 201' ' ' LEU . 77.9 mt -73.48 -41.47 63.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.015 0.436 . . . . 10.0 110.467 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -72.45 -42.33 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.952 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -60.71 -40.18 91.3 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.281 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 30.4 t90 -64.78 -35.52 81.36 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.374 179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -63.11 -44.75 94.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.505 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -39.91 92.44 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.301 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 83.1 t -65.48 -42.66 93.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.097 178.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 43.5 m -63.08 -46.65 86.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.694 -0.684 . . . . 10.0 111.287 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.1 p -62.63 -36.87 84.2 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.952 0.406 . . . . 10.0 110.146 179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 88.5 m -65.56 -46.49 79.28 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.434 -0.58 . . . . 10.0 109.434 178.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -37.11 80.99 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.086 -0.507 . . . . 10.0 110.638 179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 17.6 m -63.11 -44.81 94.62 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -68.35 -35.95 78.5 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.18 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 58.2 mt -63.61 -41.97 98.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.541 178.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -68.09 -30.68 69.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.699 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -69.18 -45.44 69.95 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-O 121.218 0.532 . . . . 10.0 109.647 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -72.17 -32.78 67.17 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.631 -0.713 . . . . 10.0 111.279 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.24 -36.99 64.15 Favored 'General case' 0 C--O 1.227 -0.084 0 CA-C-N 116.189 -0.46 . . . . 10.0 111.875 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -54.62 -71.48 0.71 Allowed Glycine 0 C--N 1.336 0.551 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -52.58 -42.65 60.63 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.609 2.206 . . . . 10.0 111.804 178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.459 HG22 ' HD3' ' C' ' 550' ' ' LYS . 54.7 t -57.06 -53.05 48.17 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-N 116.513 -0.312 . . . . 10.0 111.384 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 16.5 p -65.15 -39.81 93.49 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.847 -0.341 . . . . 10.0 111.29 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.15 -53.14 60.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.036 -0.529 . . . . 10.0 111.165 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.84 -36.73 78.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.332 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 232' ' ' LEU . 52.9 t80 -64.82 -42.58 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.935 -0.395 . . . . 10.0 109.935 178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.0 OUTLIER -67.35 -37.65 83.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.314 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -64.37 -49.14 72.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.118 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -65.43 -35.17 80.11 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.916 -0.584 . . . . 10.0 109.698 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 228' ' ' PHE . 0.4 OUTLIER -63.97 -41.34 97.58 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 108.788 -0.819 . . . . 10.0 108.788 179.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 237' ' ' GLU . 16.4 mm-40 -65.1 -29.46 70.32 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.981 178.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 18.0 mttp -70.53 -47.05 62.29 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.793 -0.817 . . . . 10.0 108.793 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.57 -46.0 91.76 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.971 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 6.5 p -68.27 -35.82 78.47 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.73 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 241' ' ' GLN . 20.3 tt0 -60.61 -45.19 94.94 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -62.38 -42.43 99.71 Favored Glycine 0 N--CA 1.444 -0.768 0 N-CA-C 110.247 -1.141 . . . . 10.0 110.247 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 66.7 mt -65.12 -32.46 74.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.826 0.346 . . . . 10.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -69.02 -39.64 79.14 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.199 -0.667 . . . . 10.0 109.199 178.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 237' ' ' GLU . 68.5 mt-30 -68.41 -34.55 76.21 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.117 -1.068 . . . . 10.0 108.117 177.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -69.28 -28.21 66.09 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.411 -0.813 . . . . 10.0 109.604 178.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 44.1 ttm -64.5 -27.28 68.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.206 0.527 . . . . 10.0 109.898 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 3.6 m -82.02 1.75 34.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.663 -0.699 . . . . 10.0 110.288 178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -126.14 -64.86 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.444 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.607 ' HA ' ' CZ ' ' C' ' 528' ' ' ARG . 18.9 t70 -56.48 -46.39 80.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.724 -0.671 . . . . 10.0 111.618 -179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 250' ' ' VAL . 5.7 tp -80.5 -44.56 18.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.332 -0.394 . . . . 10.0 111.288 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -60.77 -50.22 74.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.543 -0.299 . . . . 10.0 111.789 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -66.16 -30.72 71.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.593 -0.276 . . . . 10.0 111.667 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.724 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.1 p -71.95 -33.06 46.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.404 0 C-N-CA 120.254 -0.579 . . . . 10.0 110.157 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.426 ' O ' HG12 ' A' ' 254' ' ' VAL . 41.7 mtpt -80.59 -26.65 37.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.504 179.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -80.85 -42.63 21.23 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -79.5 -20.75 46.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 10.0 111.879 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.724 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 2.1 p -63.54 -26.62 41.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.732 0.301 . . . . 10.0 110.676 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.497 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 35.4 mt-30 -64.12 -61.66 6.41 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.919 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 22.4 Cg_endo -64.85 -30.8 58.1 Favored 'Trans proline' 0 C--N 1.357 0.981 0 C-N-CA 121.725 1.617 . . . . 10.0 111.387 178.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 6.7 m-30 -66.81 -49.65 65.13 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.757 0.313 . . . . 10.0 110.224 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.72 -32.01 71.49 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 5.8 t70 -62.29 -38.35 89.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.388 178.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.23 -50.28 34.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.096 -0.956 . . . . 10.0 109.502 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -63.59 -45.11 91.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.526 -0.761 . . . . 10.0 112.274 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -63.34 -42.77 98.96 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 122.488 0.315 . . . . 10.0 111.199 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.51 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.0 ttmt -61.31 -50.22 73.87 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.615 -0.513 . . . . 10.0 109.615 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 69.4 mttt -64.71 -38.02 89.57 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.537 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -63.56 -39.34 94.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 10.0 110.141 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -64.0 -45.91 86.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.341 -0.614 . . . . 10.0 109.341 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 61.1 mt-10 -60.34 -45.44 93.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.592 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 10.8 mt-10 -58.67 -48.6 80.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.679 . . . . 10.0 110.68 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 82.5 mmm -65.58 -37.78 87.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.558 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.95 -45.89 83.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.681 179.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 96.2 mt -65.94 -35.03 79.5 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.695 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 1.1 m-30 -62.6 -47.9 81.77 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.541 178.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.575 ' HA ' HG12 ' A' ' 276' ' ' VAL . 99.6 mtt180 -71.33 -32.2 68.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.011 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . 0.416 ' NE2' ' HA ' ' A' ' 274' ' ' GLN . 0.7 OUTLIER -65.57 -33.71 76.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.913 0.387 . . . . 10.0 110.311 179.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' C' ' 499' ' ' LEU . 9.5 mptt -92.09 -35.88 13.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.561 -0.745 . . . . 10.0 111.839 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.575 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.7 p -53.26 -33.75 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 N-CA-C 113.21 0.818 . . . . 10.0 113.21 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -67.54 -63.05 2.9 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 120.786 -0.366 . . . . 10.0 111.686 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.49 -34.82 85.0 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.841 1.694 . . . . 10.0 111.898 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.761 HD22 ' HE3' ' C' ' 495' ' ' LYS . 14.3 mt -63.95 -47.11 81.75 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 110.214 -0.291 . . . . 10.0 110.214 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -60.14 -37.17 79.3 Favored 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -62.36 -50.58 71.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.769 -0.65 . . . . 10.0 109.842 178.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -60.08 -42.4 94.52 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.143 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 279' ' ' LEU . 85.6 mt -62.28 -45.69 92.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.248 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -64.74 -40.6 95.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.706 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -58.95 -51.77 68.62 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -62.43 -39.86 98.33 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.516 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.03 87.58 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 110.193 -0.299 . . . . 10.0 110.193 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 -57.93 -51.65 68.74 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.229 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -59.99 -52.44 65.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.758 -0.656 . . . . 10.0 111.791 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.47 -40.55 97.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.346 -0.388 . . . . 10.0 111.933 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 291' ' ' LEU . 37.9 mt -68.41 -35.82 78.2 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -64.95 -42.19 94.83 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.075 -0.512 . . . . 10.0 109.635 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.29 -39.78 91.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.894 -0.594 . . . . 10.0 109.436 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 96.1 mt -71.14 -41.21 70.78 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.489 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -63.08 -42.28 99.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.04 -0.356 . . . . 10.0 110.04 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -70.04 -5.77 28.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.877 -0.601 . . . . 10.0 111.523 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.502 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 20.7 mmtp -108.84 -43.26 4.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.315 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 298' ' ' LEU . 16.7 mt -62.92 -25.25 68.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.633 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.558 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 7.1 m -70.1 -62.36 2.33 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 120.828 -0.349 . . . . 10.0 111.309 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.558 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 43.2 Cg_endo -68.88 -43.06 3.77 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 121.762 1.641 . . . . 10.0 112.173 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.648 HD22 ' HG2' ' C' ' 473' ' ' LYS . 84.8 mt -67.43 -32.34 73.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -67.02 -48.51 59.8 Favored Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 110.14 -1.184 . . . . 10.0 110.14 178.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.85 -44.27 97.22 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.716 -0.476 . . . . 10.0 109.716 178.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.16 -43.89 98.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 10.0 110.362 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 5.5 tpt -64.05 -41.72 97.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.527 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 35.6 mtt180 -66.42 -39.2 88.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.127 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -66.67 -45.16 79.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.233 0.539 . . . . 10.0 109.631 179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.445 ' HG3' HD21 ' C' ' 469' ' ' LEU . 28.3 mmt180 -64.7 -35.7 81.9 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.238 -0.653 . . . . 10.0 109.238 178.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.31 82.3 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 109.363 -0.606 . . . . 10.0 109.363 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 67.2 mtt180 -59.81 -50.39 73.99 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.073 -0.714 . . . . 10.0 109.073 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -67.17 -36.05 80.97 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.476 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.99 -57.34 12.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.061 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.725 ' HA ' HD12 ' A' ' 316' ' ' LEU . 61.9 t -66.17 -36.89 78.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.518 -0.764 . . . . 10.0 111.601 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 3.4 t70 -62.28 -41.66 98.68 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.684 -0.488 . . . . 10.0 109.684 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.48 99.15 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.159 -0.682 . . . . 10.0 109.159 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.1 mt -62.4 -49.03 77.14 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.241 -0.89 . . . . 10.0 109.706 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 317' ' ' ARG . 16.1 mtm105 -60.49 -43.13 97.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.198 -0.456 . . . . 10.0 111.025 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 24.3 m -62.86 -27.16 69.15 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.161 0.505 . . . . 10.0 111.347 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -89.07 -40.08 13.2 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.971 0.415 . . . . 10.0 110.057 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 92.9 mt -63.71 -30.21 71.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.044 -0.526 . . . . 10.0 112.231 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.436 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -56.54 -61.39 6.85 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 111.552 0.204 . . . . 10.0 111.552 179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.436 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 43.2 Cg_endo -70.45 -27.66 22.93 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.438 1.425 . . . . 10.0 111.162 178.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.575 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 9.9 m-30 -63.45 -52.59 60.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.769 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 13.1 p -60.58 -38.14 83.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.819 0.342 . . . . 10.0 110.284 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.489 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 21.3 t70 -62.08 -48.3 80.82 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.036 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.56 -32.72 71.68 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.975 -0.557 . . . . 10.0 110.707 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 79.5 mt -65.82 -33.48 75.96 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.0 -0.741 . . . . 10.0 109.0 177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.47 ' HA ' HD12 ' A' ' 331' ' ' LEU . 57.3 mtt180 -69.85 -35.1 74.46 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 73.3 mt-30 -66.46 -39.48 88.84 Favored 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 107.66 -1.237 . . . . 10.0 107.66 177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.55 HH21 ' HB3' ' C' ' 447' ' ' GLU . 42.4 mtt180 -65.78 -44.7 85.0 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.427 -0.806 . . . . 10.0 109.025 178.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . 0.47 HD12 ' HA ' ' A' ' 328' ' ' ARG . 15.9 mt -57.06 -51.72 68.15 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.391 178.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.407 ' O ' ' HG2' ' A' ' 336' ' ' GLU . . . -60.06 -50.73 72.55 Favored 'General case' 0 N--CA 1.452 -0.36 0 O-C-N 123.619 0.574 . . . . 10.0 110.217 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -55.01 -48.6 73.14 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.054 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.442 ' O ' ' HG ' ' A' ' 338' ' ' LEU . 48.7 mtt-85 -65.99 -41.28 91.3 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.496 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 18.1 mt -61.4 -39.77 91.93 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.63 -0.259 . . . . 10.0 110.753 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 332' ' ' ALA . 27.9 mm-40 -57.47 -51.17 70.51 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 109.394 -0.595 . . . . 10.0 109.394 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.65 91.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.874 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 334' ' ' ARG . 84.7 mt -67.41 -17.69 64.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.932 0.396 . . . . 10.0 111.503 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -96.48 -51.41 4.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.874 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.2 -54.78 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.959 0.409 . . . . 10.0 110.164 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.631 HD21 ' HB3' ' C' ' 432' ' ' LYS . 13.6 t-20 -74.07 -32.8 63.43 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.54 -0.541 . . . . 10.0 109.54 179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.448 ' HA2' ' HE ' ' A' ' 345' ' ' ARG . . . -59.39 -51.44 59.11 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.413 -0.812 . . . . 10.0 111.957 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.33 -38.52 95.85 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.146 -0.781 . . . . 10.0 111.146 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 348' ' ' GLU . . . -62.59 -40.68 97.67 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.936 0.398 . . . . 10.0 110.171 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.449 ' HD3' ' HG2' ' C' ' 433' ' ' GLU . 77.6 mtm180 -69.45 -41.26 76.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.199 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 92.5 mt -60.28 -49.79 76.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.724 0.297 . . . . 10.0 110.725 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.27 -39.27 92.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.183 0.516 . . . . 10.0 110.055 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.529 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 4.6 tt0 -64.08 -45.21 89.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.293 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -65.01 -33.48 76.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.841 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -64.98 -41.52 95.35 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.563 -0.903 . . . . 10.0 108.563 177.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.33 91.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.631 -0.713 . . . . 10.0 109.604 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 29.6 mttm -60.57 -46.55 89.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -60.21 -41.86 93.9 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.82 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 31.9 m -59.39 -44.77 92.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.95 0.405 . . . . 10.0 110.342 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -67.62 -42.16 82.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.268 -0.423 . . . . 10.0 110.035 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -58.73 -41.86 87.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.033 178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 72.7 mt -66.78 -36.84 83.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.022 -0.536 . . . . 10.0 110.297 179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 48.6 m -64.46 -38.14 90.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.259 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.02 -26.69 48.61 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.533 -0.543 . . . . 10.0 109.533 178.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.15 -31.61 72.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.901 -0.59 . . . . 10.0 109.829 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 11.3 m -60.88 -30.79 70.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.14 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -68.43 -24.69 64.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.244 0.545 . . . . 10.0 109.754 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.769 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 80.9 mttt -92.58 -36.35 13.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 110.181 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 368' ' ' LEU . . . -72.29 -35.51 68.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.628 -0.715 . . . . 10.0 112.522 -179.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.906 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 84.7 mttt -104.04 -74.71 0.03 OUTLIER Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 113.191 0.812 . . . . 10.0 113.191 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.906 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 51.5 Cg_exo -56.04 -57.37 1.54 Allowed 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.112 1.875 . . . . 10.0 113.315 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.769 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.19 -50.39 73.85 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.384 0.513 . . . . 10.0 112.384 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.513 HD23 HD12 ' A' ' 371' ' ' LEU . 9.0 mt -60.64 -42.03 96.09 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 121.09 -0.244 . . . . 10.0 111.635 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -65.7 -38.66 89.83 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.626 -0.509 . . . . 10.0 109.626 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -42.27 99.73 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.901 -0.778 . . . . 10.0 108.901 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.513 HD12 HD23 ' A' ' 368' ' ' LEU . 80.2 mt -64.88 -40.65 95.45 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.35 -0.841 . . . . 10.0 109.764 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.447 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 98.2 mtt180 -65.22 -43.1 92.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.193 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -62.91 -36.89 84.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.72 -0.673 . . . . 10.0 110.292 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.23 -32.99 50.53 Favored Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.276 -0.729 . . . . 10.0 111.276 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 15.9 mt -68.9 -27.34 65.69 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.838 -0.213 . . . . 10.0 111.315 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 96.9 mt -53.87 -61.22 5.58 Favored Pre-proline 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 10.0 112.303 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -65.98 -33.2 42.74 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 121.865 1.71 . . . . 10.0 111.163 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 40.9 t -61.09 -50.01 82.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.512 -0.313 . . . . 10.0 110.227 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 77.1 mt -64.24 -35.45 80.87 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.952 0.406 . . . . 10.0 110.002 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.454 ' O ' HG23 ' A' ' 384' ' ' VAL . 43.6 tt0 -62.3 -51.9 65.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.915 178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.5 p -62.7 -37.46 86.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.081 -0.508 . . . . 10.0 110.778 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.93 -45.49 92.42 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 92.9 mttt -65.12 -37.06 86.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.758 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 380' ' ' GLU . 61.6 t -59.38 -49.61 82.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.305 0.378 . . . . 10.0 109.982 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 2.4 p -69.85 -36.89 75.9 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.623 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.15 -49.73 75.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.189 -0.46 . . . . 10.0 110.788 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 383' ' ' LYS . 81.1 mt -57.9 -47.9 81.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.795 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.531 ' HB2' ' CE ' ' C' ' 594' ' ' LYS . 3.4 p -65.68 -34.22 77.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.704 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.63 78.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.89 0.376 . . . . 10.0 110.429 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 45.5 mt -63.32 -38.87 92.85 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.35 0.595 . . . . 10.0 109.42 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.479 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 76.0 mt-10 -72.45 -39.3 67.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.479 -0.782 . . . . 10.0 109.957 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -56.2 -48.51 76.26 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.065 -0.516 . . . . 10.0 111.338 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -61.7 -52.9 62.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.394 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.9 m -63.28 -28.44 70.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.836 -0.62 . . . . 10.0 112.052 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 31.2 ttmt -68.34 -39.38 81.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.165 0.431 . . . . 10.0 112.165 -178.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -105.86 -17.31 14.4 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.048 1.129 . . . . 10.0 114.048 -178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 95.1 mt -101.66 -3.33 28.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 10.0 111.722 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 116.6 -0.273 . . . . 10.0 110.897 -179.727 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mm? . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 121.142 0.496 . . . . 10.0 110.471 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . 0.451 ' HB2' ' HE2' ' C' ' 400' ' ' LYS . 3.2 mppt? -105.78 3.51 28.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.26 0.553 . . . . 10.0 110.057 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 13.6 mt -59.08 -36.45 75.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.268 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 19.3 mt -60.05 -43.53 95.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.813 -0.63 . . . . 10.0 111.521 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.66 -33.64 71.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.05 0.452 . . . . 10.0 110.823 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -72.23 -36.15 69.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.028 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -33.58 74.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.939 179.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -57.95 -50.56 72.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.456 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -37.17 85.15 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.806 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.52 -49.85 82.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.749 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 62.6 m -63.74 -39.88 95.37 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.989 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 51.0 m -64.13 -39.37 93.89 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.832 0.349 . . . . 10.0 110.23 178.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 93.9 m -66.79 -37.89 85.45 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' C' ' 415' ' ' LEU . 4.5 m-85 -66.42 -31.98 73.07 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.063 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 19.3 m -68.36 -40.67 81.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 63.5 mmtt -66.11 -28.6 68.93 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' C' ' 412' ' ' PHE . 0.5 OUTLIER -64.88 -43.33 93.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.651 178.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . . . . . . . . . 55.5 mtt180 -68.85 -37.32 79.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.09 178.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -59.7 -33.11 71.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.404 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -81.87 -46.15 14.5 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 22.6 mt -49.58 -41.11 40.95 Favored 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.557 -0.747 . . . . 10.0 112.248 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -54.73 -76.46 0.19 Allowed Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.006 -0.616 . . . . 10.0 112.666 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.491 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 53.1 Cg_exo -55.0 -40.67 84.76 Favored 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 122.662 2.241 . . . . 10.0 112.109 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 17.8 t -58.07 -51.41 71.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.219 0 N-CA-C 112.148 0.425 . . . . 10.0 112.148 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 24.7 p -64.3 -37.27 86.91 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.233 -0.292 . . . . 10.0 111.092 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.2 mt-30 -58.83 -53.76 54.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.447 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 10.8 pt-20 -75.82 -25.55 56.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 10.0 111.756 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -68.74 -40.1 80.02 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 3.2 m0 -64.09 -39.04 93.18 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.59 -0.893 . . . . 10.0 108.59 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.13 -38.41 85.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.119 -0.946 . . . . 10.0 108.908 178.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.529 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 2.4 t30 -63.18 -44.79 94.43 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.216 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 76.4 mt -60.0 -38.15 81.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.215 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.67 -31.92 71.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.394 -0.366 . . . . 10.0 110.376 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.631 ' HB3' HD21 ' A' ' 341' ' ' ASN . 26.2 mttp -70.85 -44.53 66.22 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.449 ' HG2' ' HD3' ' A' ' 345' ' ' ARG . 44.9 mt-10 -63.62 -48.29 77.92 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.634 -0.712 . . . . 10.0 110.7 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 4.5 p -58.62 -56.38 22.92 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.66 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -59.49 -39.77 84.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.697 0.284 . . . . 10.0 111.189 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -62.87 -50.49 63.33 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.745 -0.74 . . . . 10.0 111.278 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.51 -30.86 70.64 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.381 -0.229 . . . . 10.0 110.381 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -67.73 -34.71 77.38 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.418 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.97 -36.01 82.55 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.723 -0.843 . . . . 10.0 108.723 177.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.47 -44.93 61.62 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.165 -0.925 . . . . 10.0 108.695 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 78.3 mmm -60.98 -39.89 91.38 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.167 -0.924 . . . . 10.0 113.107 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.91 -51.17 70.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.035 0.445 . . . . 10.0 110.078 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -70.21 -38.19 75.21 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.871 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 6.0 t70 -59.59 -50.04 75.43 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.666 -179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.58 -48.18 50.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.255 -0.429 . . . . 10.0 112.148 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -59.27 -45.77 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.064 0.459 . . . . 10.0 110.487 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.55 ' HB3' HH21 ' A' ' 330' ' ' ARG . 27.3 tt0 -71.05 -30.96 67.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.168 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -61.92 -33.76 59.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.114 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -66.73 -38.04 85.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.427 -0.953 . . . . 10.0 108.427 178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -85.99 12.74 8.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.258 -0.883 . . . . 10.0 110.512 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -121.06 -45.28 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 10.0 109.888 178.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 91.7 t -66.48 -41.03 87.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.566 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -57.24 -59.39 12.92 Favored Pre-proline 0 CA--C 1.535 0.403 0 N-CA-C 112.465 0.543 . . . . 10.0 112.465 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.1 -31.94 35.48 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 121.927 1.751 . . . . 10.0 112.266 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -68.67 -47.04 67.49 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.876 -0.416 . . . . 10.0 109.876 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' C' ' 456' ' ' LEU . 13.8 mt -65.29 -36.0 82.75 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -64.8 -46.4 82.2 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 178.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.04 -42.58 98.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.592 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . 0.454 ' HD1' ' HA ' ' C' ' 459' ' ' PHE . 0.0 OUTLIER -68.14 -42.16 80.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.605 178.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -57.27 -46.01 83.51 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 123.384 0.428 . . . . 10.0 110.055 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 28.3 mttp -62.66 -38.67 91.23 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.711 -0.677 . . . . 10.0 109.926 179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.75 -39.71 76.58 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.996 0.427 . . . . 10.0 111.267 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.65 ' CD1' ' H71' ' C' ' 629' ' ' 17F . 41.2 m0 -68.67 -39.49 80.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.376 -0.601 . . . . 10.0 109.376 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -65.76 -44.23 86.5 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.095 -0.706 . . . . 10.0 109.095 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 25.4 mt-10 -57.05 -53.94 52.38 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.68 -0.691 . . . . 10.0 109.218 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.14 -38.32 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.875 -0.602 . . . . 10.0 110.771 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 47.6 ttm -62.06 -49.74 74.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.028 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -63.64 -36.5 84.04 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.085 -0.507 . . . . 10.0 109.866 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 79.6 mt -64.97 -42.23 94.76 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.781 178.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 12.6 m-30 -66.45 -29.45 69.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.713 179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 86.9 mtt180 -70.1 -27.28 64.47 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.661 -0.496 . . . . 10.0 109.661 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -97.67 -8.98 27.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.215 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.648 ' HG2' HD22 ' A' ' 301' ' ' LEU . 60.5 mttp -112.79 -72.87 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.231 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 86.2 t -55.21 -45.31 77.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 112.779 0.659 . . . . 10.0 112.779 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.688 ' HB2' ' HD3' ' C' ' 476' ' ' PRO . 15.8 mt-10 -57.68 -59.46 12.95 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 112.647 0.61 . . . . 10.0 112.647 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 41.0 Cg_exo -62.71 -39.06 45.53 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.44 2.093 . . . . 10.0 111.038 178.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.68 -28.53 69.15 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.479 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -63.14 -33.03 74.59 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.533 -0.914 . . . . 10.0 108.533 178.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -76.4 -41.03 49.18 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.162 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.31 -45.57 92.94 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.644 0.735 . . . . 10.0 109.456 178.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.11 -31.39 65.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.331 178.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -65.66 -51.63 57.95 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 109.578 -0.527 . . . . 10.0 109.578 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -64.29 -40.59 96.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.662 -0.699 . . . . 10.0 109.234 179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.62 -41.49 99.59 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.104 -0.798 . . . . 10.0 111.104 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.76 -40.36 84.05 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -62.61 -44.64 95.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.496 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.433 ' O ' ' HG3' ' C' ' 491' ' ' GLU . 21.6 mm-40 -61.68 -46.06 91.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.151 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -63.72 -43.3 96.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.533 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.1 -36.52 83.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.973 -0.558 . . . . 10.0 109.537 178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 -66.01 -44.01 86.02 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 108.185 -1.042 . . . . 10.0 108.185 177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 39.7 mt-10 -58.83 -45.5 89.87 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.944 -0.761 . . . . 10.0 108.944 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 98.2 mt -66.24 -41.46 89.96 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.03 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.15 -38.17 87.99 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.137 -0.32 . . . . 10.0 110.137 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.0 3.52 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.903 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.761 ' HE3' HD22 ' A' ' 279' ' ' LEU . 23.9 mttp -122.43 -44.46 2.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.129 179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.494 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.4 mt -56.44 -28.47 59.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 10.0 112.043 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.509 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 6.7 m -82.44 -63.73 0.27 Allowed Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 40.5 Cg_endo -66.27 -45.97 4.84 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.845 1.696 . . . . 10.0 112.225 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.73 HD21 ' HG2' ' A' ' 275' ' ' LYS . 90.3 mt -74.57 -30.45 61.73 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.946 0.403 . . . . 10.0 109.96 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.494 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -63.44 -45.96 93.67 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.232 -1.147 . . . . 10.0 110.232 178.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 27.3 tt0 -61.48 -50.36 73.04 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.243 -0.651 . . . . 10.0 109.243 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.747 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.8 mmm -63.26 -37.62 87.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 10.0 110.09 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -65.82 -37.46 86.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.11 -0.496 . . . . 10.0 110.462 178.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -70.63 -36.09 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.319 -0.623 . . . . 10.0 109.319 178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 43.4 mtt180 -62.88 -46.14 89.23 Favored 'General case' 0 CA--C 1.518 -0.261 0 N-CA-C 107.889 -1.152 . . . . 10.0 107.889 177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.87 82.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.503 178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . . . . . . . . . 61.4 mtt180 -62.49 -41.59 98.91 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.05 -38.23 90.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 10.0 110.561 179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.609 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 74.4 m-70 -72.58 -46.26 55.17 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.272 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . . . . . . . . . 23.9 t -62.75 -44.25 99.35 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.765 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.777 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 10.0 t70 -64.83 -34.25 77.91 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.296 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -64.81 -46.04 83.67 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.323 -0.991 . . . . 10.0 108.323 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 63.6 mt -59.21 -26.97 65.29 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.71 179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.777 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 94.5 mtt180 -65.53 -32.99 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.084 -0.507 . . . . 10.0 110.623 179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.18 -2.33 24.31 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.128 0.49 . . . . 10.0 111.201 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 34.1 m170 -106.01 -64.34 1.17 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.922 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 72.2 mt -77.84 -47.38 18.97 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.793 0.664 . . . . 10.0 112.793 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.605 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.14 -57.29 15.73 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 113.511 0.93 . . . . 10.0 113.511 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.605 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 26.0 Cg_exo -65.3 -33.4 48.45 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.986 1.791 . . . . 10.0 111.018 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.48 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 9.3 t80 -65.06 -32.24 73.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.325 -0.398 . . . . 10.0 110.334 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 51.0 m -63.41 -33.58 75.86 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.53 -0.545 . . . . 10.0 109.53 178.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 6.6 t0 -70.45 -38.93 74.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.395 178.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -40.74 93.97 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.382 -0.97 . . . . 10.0 108.382 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . . . . . . . . . 27.9 mt -63.73 -35.92 82.16 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.203 -0.908 . . . . 10.0 110.089 178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 59.5 mtt180 -62.18 -39.98 94.5 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.83 -0.433 . . . . 10.0 109.83 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -67.18 -40.38 86.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.856 -0.611 . . . . 10.0 109.614 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.607 ' CZ ' ' HA ' ' A' ' 246' ' ' ASP . 89.1 mtt180 -69.04 -44.35 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.451 -0.795 . . . . 10.0 110.048 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.89 -32.9 74.26 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.131 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.98 -41.8 95.1 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.196 -0.668 . . . . 10.0 109.196 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -71.14 -39.23 72.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.782 -0.644 . . . . 10.0 109.387 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.467 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 13.5 ttm180 -63.57 -49.32 73.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.307 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 56.5 mt -62.6 -36.42 82.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.759 -0.655 . . . . 10.0 109.919 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -59.79 -48.23 82.52 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.525 -0.546 . . . . 10.0 109.525 179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.38 93.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.104 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 90.6 mt -66.46 -34.98 79.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.901 -0.591 . . . . 10.0 110.975 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -73.07 -44.61 60.35 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 110.124 -0.325 . . . . 10.0 110.124 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.9 -54.29 40.85 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.034 -0.53 . . . . 10.0 109.949 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -67.05 -32.97 74.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.227 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -65.58 -46.63 83.6 Favored Glycine 0 N--CA 1.448 -0.518 0 N-CA-C 111.274 -0.73 . . . . 10.0 111.274 179.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.71 -39.49 95.31 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 110.354 -1.098 . . . . 10.0 110.354 178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -62.5 -48.86 77.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' C' ' 543' ' ' ARG . 45.8 mtt85 -64.49 -36.15 83.24 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.967 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 24.1 mt -61.17 -44.44 97.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.045 -0.724 . . . . 10.0 109.045 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.78 -40.66 92.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.015 178.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -65.75 -47.36 75.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.306 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -63.7 -33.02 74.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.399 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -72.28 -39.66 68.18 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.845 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -66.69 -43.33 84.71 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.638 -0.875 . . . . 10.0 108.638 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.459 ' HD3' HG22 ' A' ' 224' ' ' VAL . 0.0 OUTLIER -68.45 -24.9 64.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.54 -0.755 . . . . 10.0 109.969 179.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -66.06 -46.99 75.78 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 108.495 -0.928 . . . . 10.0 108.495 178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.84 -44.21 93.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.667 -0.697 . . . . 10.0 109.329 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -58.01 -54.06 51.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.539 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.413 ' O ' ' HG ' ' C' ' 558' ' ' LEU . 0.9 OUTLIER -62.29 -36.71 82.97 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.744 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 31.5 tp -59.86 -46.77 88.25 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.037 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.78 -32.04 73.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.487 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' C' ' 560' ' ' GLU . 10.7 m -74.02 -36.06 64.42 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.109 0.48 . . . . 10.0 110.152 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' C' ' 554' ' ' HIS . 63.3 mt -64.45 -53.3 50.48 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.85 -0.613 . . . . 10.0 109.438 178.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 6.4 p -63.6 -28.96 70.28 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.961 0.41 . . . . 10.0 110.396 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' C' ' 557' ' ' THR . 35.6 tt0 -61.44 -29.21 69.81 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.51 -0.768 . . . . 10.0 109.803 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.44 22.5 10.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.746 179.283 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -111.77 -55.85 2.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.582 -0.735 . . . . 10.0 109.412 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' C' ' 567' ' ' GLU . 75.0 mttt -58.32 -56.6 33.56 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.77 -0.65 . . . . 10.0 111.494 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' C' ' 563' ' ' LYS . 33.7 Cg_endo -64.79 -29.71 59.06 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.699 1.599 . . . . 10.0 111.4 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.56 65.32 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-N 116.454 -0.339 . . . . 10.0 110.232 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 79.6 mt -59.68 -40.79 88.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.267 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 563' ' ' LYS . 17.5 mm-40 -66.46 -50.37 63.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.497 179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -61.14 -48.54 81.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.308 -0.406 . . . . 10.0 110.392 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 33.3 mt -59.13 -43.19 91.99 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.959 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . 0.417 ' O ' ' HG ' ' C' ' 574' ' ' LEU . 16.2 ttm105 -69.06 -38.01 78.84 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.064 -0.347 . . . . 10.0 110.064 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -64.47 -21.41 66.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.928 -0.578 . . . . 10.0 110.211 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . 0.44 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -97.59 -33.74 5.77 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.058 -0.817 . . . . 10.0 111.058 178.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.528 ' HA ' HG12 ' C' ' 576' ' ' VAL . 17.1 mt -67.36 -40.46 85.79 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.462 0.305 . . . . 10.0 111.35 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' C' ' 570' ' ' ARG . 76.6 mt -54.99 -59.75 9.93 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.78 -31.03 33.01 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 121.931 1.754 . . . . 10.0 111.907 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.3 OUTLIER -69.86 -36.79 71.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 120.784 -0.366 . . . . 10.0 110.715 179.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 18.7 mt -67.0 -37.08 83.54 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -63.44 -39.65 95.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.203 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 18.9 m -70.2 -36.1 74.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.775 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -62.74 -41.56 99.24 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.629 -0.508 . . . . 10.0 109.629 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -59.05 -39.98 83.72 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.954 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 80.3 t -61.59 -50.61 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.752 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.33 -39.13 89.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.139 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -64.11 -49.92 70.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.547 -0.297 . . . . 10.0 110.656 179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.19 -47.88 82.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.568 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 14.8 p -61.34 -32.55 72.45 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 120.962 0.41 . . . . 10.0 110.946 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -73.88 -52.99 11.2 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.083 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 95.5 mt -57.88 -43.58 86.12 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.295 -0.411 . . . . 10.0 112.048 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -57.24 -53.27 59.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.927 0.394 . . . . 10.0 110.97 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -70.96 -35.27 72.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.875 0.694 . . . . 10.0 112.875 -179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.612 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 5.7 m-30 -61.36 -38.44 86.99 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.913 0.387 . . . . 10.0 110.315 179.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 15.9 m -68.27 -31.27 70.61 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.172 -0.467 . . . . 10.0 109.981 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -77.53 -35.98 52.83 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.523 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.531 ' CE ' ' HB2' ' A' ' 388' ' ' SER . 12.4 mptt -69.96 -34.84 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.789 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 85.8 mt -101.03 33.47 2.83 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 10.0 110.662 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.972 -0.558 . . . . 10.0 111.244 179.668 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.1 mmt . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 121.221 0.534 . . . . 10.0 110.604 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.86 125.18 28.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.63 -179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -91.72 140.22 29.91 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.188 0.44 . . . . 10.0 112.188 -178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -133.41 124.98 28.09 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.54 -0.911 . . . . 10.0 108.54 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -83.32 114.3 21.32 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.628 0.251 . . . . 10.0 111.227 -179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.644 ' HB2' HG22 ' B' ' 55' ' ' ILE . 21.5 mt -116.96 141.12 48.64 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.884 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.5 ' O ' ' HA ' ' B' ' 78' ' ' PHE . 71.9 t -134.55 123.92 43.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.378 179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' B' ' 79' ' ' LEU . 27.3 m -95.11 141.73 14.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.024 0.44 . . . . 10.0 111.038 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 80' ' ' CYS . 3.9 m -125.64 141.41 45.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.44 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.62 172.48 43.76 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.389 -0.91 . . . . 10.0 112.22 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.94 -174.34 3.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.69 0.281 . . . . 10.0 110.551 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -84.77 134.23 12.48 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.271 -0.966 . . . . 10.0 112.004 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 89.89 17.77 52.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.985 -0.626 . . . . 10.0 112.751 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.533 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 30.6 m -95.9 -17.09 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.637 ' CA ' ' H8 ' ' B' ' 216' ' ' GNP . . . 88.65 32.78 10.84 Favored Glycine 0 CA--C 1.516 0.122 0 C-N-CA 120.53 -0.843 . . . . 10.0 111.594 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.401 ' N ' ' O1B' ' B' ' 216' ' ' GNP . 20.2 ttpp -66.28 -42.25 88.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.937 0.398 . . . . 10.0 110.678 -179.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 64.9 m -78.19 -33.09 50.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.054 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -50.43 73.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.469 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.49 -44.51 95.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.99 0.424 . . . . 10.0 110.561 179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.432 HG23 HD12 ' B' ' 55' ' ' ILE . 87.6 m -58.81 -52.55 65.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.759 -0.655 . . . . 10.0 111.731 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.684 HD13 ' CG1' ' D' ' 388' ' ' VAL . 18.6 mt -65.96 -41.06 89.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.748 0.309 . . . . 10.0 111.327 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 25.8 tp60 -62.71 -36.18 82.12 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.726 0.639 . . . . 10.0 112.726 -178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 12.4 tp -86.0 -32.35 21.54 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.272 0.842 . . . . 10.0 113.272 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.524 HG21 ' HD2' ' B' ' 40' ' ' TYR . 27.0 mm -91.76 -55.76 5.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 112.668 0.618 . . . . 10.0 112.668 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.658 ' HG2' ' HE2' ' B' ' 40' ' ' TYR . 95.6 mm-40 -89.39 -12.22 40.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.512 0.56 . . . . 10.0 112.512 -178.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.466 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 36.5 m-80 61.98 41.55 11.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.174 0.511 . . . . 10.0 110.71 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -130.14 146.97 51.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.768 -0.651 . . . . 10.0 109.725 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -109.63 128.35 55.17 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.884 0.374 . . . . 10.0 110.654 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.18 161.27 3.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.807 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -130.43 -23.44 2.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.56 0.695 . . . . 10.0 110.553 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -104.19 156.52 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.952 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.767 ' HD1' H5'1 ' B' ' 216' ' ' GNP . 61.7 t80 -104.18 118.95 37.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.911 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -135.69 117.86 12.2 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 108.772 -0.825 . . . . 10.0 108.772 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.18 123.24 12.75 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.225 2.617 . . . . 10.0 112.512 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -96.25 133.55 40.45 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.495 179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' D' ' 371' ' ' ASN . 55.5 mt -102.22 -75.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.56 -0.456 . . . . 10.0 110.786 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.694 ' HB3' HG23 ' D' ' 369' ' ' VAL . 30.1 tt0 -123.34 96.43 4.99 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.176 -0.676 . . . . 10.0 109.176 179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 32.5 t0 -117.37 108.46 15.61 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.283 -0.417 . . . . 10.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.541 ' O ' ' HG3' ' D' ' 366' ' ' GLN . 1.4 m -99.14 121.81 41.51 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.611 -0.268 . . . . 10.0 110.986 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.658 ' HE2' ' HG2' ' B' ' 25' ' ' GLN . 6.2 m-85 -118.48 140.79 49.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.17 -0.468 . . . . 10.0 109.993 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.416 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 8.0 ttp180 -136.09 138.05 41.68 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.592 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -150.45 143.43 24.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.898 0.38 . . . . 10.0 111.458 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -95.89 119.48 34.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.563 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 1.6 m -137.8 143.48 33.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 10.0 111.78 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 23.4 t -83.86 96.45 4.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 37.3 mt -98.43 95.82 4.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.129 0.49 . . . . 10.0 111.077 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 60.75 66.21 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.133 -0.939 . . . . 10.0 112.656 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.02 -60.2 4.63 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.561 -0.745 . . . . 10.0 113.49 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.469 ' HB2' HH22 ' B' ' 164' ' ' ARG . 27.8 mt-10 -76.92 148.48 36.37 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.279 0.474 . . . . 10.0 112.279 -178.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.0 m -89.21 110.8 21.51 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.096 -1.076 . . . . 10.0 108.096 178.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 24.8 m -104.1 137.33 42.2 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.574 0.583 . . . . 10.0 112.574 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 25.1 tp -95.9 105.47 17.5 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.128 -0.942 . . . . 10.0 108.877 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.534 HD22 HD11 ' B' ' 6' ' ' LEU . 31.4 mt -81.75 112.42 18.89 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.616 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -107.88 97.59 7.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 10.0 108.811 178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.644 HG22 ' HB2' ' B' ' 6' ' ' LEU . 6.5 pt -107.76 130.02 60.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.41 0.624 . . . . 10.0 111.652 -178.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.3 tp -110.76 111.0 21.87 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.421 -0.808 . . . . 10.0 109.818 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.637 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 36.8 t0 -86.37 124.83 33.15 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.048 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.49 -171.87 2.03 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.341 -179.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -84.63 131.84 34.55 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.171 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -78.84 -20.15 71.41 Favored Glycine 0 N--CA 1.451 -0.3 0 N-CA-C 110.689 -0.964 . . . . 10.0 110.689 178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -116.98 87.46 2.7 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.382 -0.599 . . . . 10.0 109.382 179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -155.43 153.38 30.26 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.936 -0.394 . . . . 10.0 109.936 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -101.46 -149.48 0.38 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.745 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -76.83 111.81 12.75 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.071 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -128.36 119.23 24.63 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.981 179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.45 -30.37 68.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.305 -0.407 . . . . 10.0 111.64 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 5.3 tmm? -69.02 -33.36 73.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.686 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.696 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.6 ttm-85 -66.36 -38.1 86.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 10.0 110.603 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . 0.445 ' HA ' ' HE2' ' B' ' 72' ' ' MET . 81.1 m-20 -57.88 -32.72 67.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.14 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -55.97 -65.16 0.65 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.696 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 6.1 p90 -69.64 -21.91 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' B' ' 69' ' ' ASP . 4.6 ttp -65.27 -35.94 82.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.122 0.486 . . . . 10.0 109.721 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.437 ' HB2' HG12 ' B' ' 103' ' ' VAL . 42.8 ttm180 -75.61 -28.2 58.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.64 179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 25.4 m -66.96 -36.43 82.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.135 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.11 147.22 47.39 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.959 -0.639 . . . . 10.0 112.895 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -99.6 -59.48 1.71 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.129 0.49 . . . . 10.0 109.909 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.99 141.14 15.42 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.691 -0.766 . . . . 10.0 111.219 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.798 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 71.5 m-85 -123.23 139.01 54.5 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.06 0.457 . . . . 10.0 111.742 -179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.744 ' HB2' HG12 ' B' ' 8' ' ' VAL . 78.2 mt -115.88 112.91 22.62 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.394 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.45 ' HA ' HG23 ' B' ' 9' ' ' VAL . 4.5 m -86.74 98.26 11.06 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.627 -0.509 . . . . 10.0 109.627 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.514 HG12 ' HB ' ' B' ' 114' ' ' VAL . 18.8 m -99.21 129.0 50.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.422 0.629 . . . . 10.0 111.976 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.765 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 47.4 p90 -137.77 158.04 45.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.635 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.533 ' HB2' ' HA ' ' B' ' 14' ' ' VAL . . . -96.27 124.28 40.21 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.97 -0.559 . . . . 10.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.516 HD11 ' HA ' ' B' ' 118' ' ' CYS . 2.4 pp -72.92 -7.67 10.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.051 0.389 . . . . 10.0 112.051 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -88.01 -7.98 56.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.748 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 21.1 t30 -123.91 132.29 53.71 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.079 -0.712 . . . . 10.0 109.079 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -21.02 32.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.416 0.524 . . . . 10.0 112.416 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -69.32 -37.01 77.54 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.04 0.385 . . . . 10.0 112.04 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.765 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -58.02 -32.63 68.12 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.302 0.482 . . . . 10.0 112.302 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -60.32 -43.72 96.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 10.0 110.881 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -79.79 -29.68 40.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.197 0.522 . . . . 10.0 110.64 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.412 ' HB2' ' HA ' ' B' ' 89' ' ' SER . 0.8 OUTLIER -64.09 -36.87 85.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.083 179.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 89' ' ' SER . 24.4 mm -56.1 -41.21 68.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.134 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 61.8 t60 -61.82 -38.08 86.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.229 -0.441 . . . . 10.0 110.97 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -64.1 -46.7 83.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.254 0.549 . . . . 10.0 109.605 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -66.21 -31.42 72.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.528 -0.76 . . . . 10.0 110.568 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.468 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 0.3 OUTLIER -63.11 -48.71 77.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.535 179.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.468 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 45.5 mm-40 -65.2 -35.33 80.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.86 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.423 ' O ' HG23 ' B' ' 103' ' ' VAL . 1.3 mt-30 -61.77 -47.28 85.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.853 -0.612 . . . . 10.0 110.516 179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.54 -44.33 98.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.004 -0.544 . . . . 10.0 109.958 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -60.44 -34.24 73.7 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.15 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 50.3 ttp85 -71.44 -45.04 63.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 111.118 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.437 HG12 ' HB2' ' B' ' 73' ' ' ARG . 50.2 t -68.37 -47.22 78.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.124 -0.489 . . . . 10.0 111.805 -179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -76.59 -19.09 58.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.402 -0.363 . . . . 10.0 111.033 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 25.1 t70 58.51 40.72 23.59 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.568 -179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 15.8 m -143.73 135.91 26.74 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.442 -0.799 . . . . 10.0 110.952 -179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -78.74 -38.42 38.85 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.611 -0.885 . . . . 10.0 108.611 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -91.79 98.44 11.61 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.977 -1.01 . . . . 10.0 110.442 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 1.7 m -133.66 134.14 23.21 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.077 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.84 102.56 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.999 2.466 . . . . 10.0 112.466 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.798 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 62.2 mtm -134.92 143.27 46.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.34 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.448 HG13 ' HG2' ' B' ' 140' ' ' PRO . 52.6 t -125.01 136.77 59.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.431 -0.35 . . . . 10.0 110.454 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.645 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.0 tp -87.73 116.55 25.94 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.514 ' HB ' HG12 ' B' ' 81' ' ' VAL . 47.6 t -117.44 119.33 61.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.976 0.417 . . . . 10.0 111.985 -178.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -99.1 116.0 5.46 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.388 -1.085 . . . . 10.0 110.388 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.41 162.14 13.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.768 0.284 . . . . 10.0 111.552 -178.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 34.5 mtmt 61.35 34.08 18.56 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.008 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.516 ' HA ' HD11 ' B' ' 84' ' ' ILE . 25.8 p -80.49 -7.83 59.33 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.263 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -87.37 -18.06 30.91 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.74 0.305 . . . . 10.0 111.157 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.436 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 78.7 mt -72.61 147.55 89.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.824 -0.625 . . . . 10.0 111.083 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 6.6 Cg_exo -76.32 26.1 0.42 Allowed 'Trans proline' 0 CA--C 1.533 0.44 0 C-N-CA 123.23 2.62 . . . . 10.0 112.644 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 9.9 m -117.48 30.62 7.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.206 0.527 . . . . 10.0 110.104 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.478 ' HA ' HD12 ' B' ' 84' ' ' ILE . 24.6 ttm-85 -62.39 106.24 0.73 Allowed 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.427 -0.806 . . . . 10.0 111.559 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -101.27 -42.3 6.37 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.47 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 46.6 t -87.14 117.26 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.619 -0.719 . . . . 10.0 109.352 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.626 ' OD2' ' H62' ' B' ' 210' ' ' PCW . 25.0 t70 -82.8 146.27 29.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.044 0.449 . . . . 10.0 111.442 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.514 HG23 ' HE2' ' B' ' 141' ' ' PHE . 1.2 m -59.07 -34.31 71.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.986 -0.552 . . . . 10.0 111.698 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.582 ' HG3' ' O1P' ' D' ' 503' ' ' PCW . 39.2 tttm -66.14 -28.24 68.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.752 0.31 . . . . 10.0 111.17 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.522 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 40.5 mt-30 -78.63 -49.72 12.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.49 . . . . 10.0 110.088 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.51 89.26 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.583 -0.735 . . . . 10.0 112.094 -179.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.451 ' OE1' ' H62' ' D' ' 506' ' ' PCW . 37.9 mt-30 -68.26 -34.75 76.77 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.377 0.51 . . . . 10.0 112.377 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 8.7 t0 -62.63 -50.1 72.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.253 0.549 . . . . 10.0 109.784 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.12 -45.03 86.78 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.4 -0.818 . . . . 10.0 110.94 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.99 -33.38 74.22 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.075 -0.512 . . . . 10.0 111.261 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.479 ' NH2' H341 ' D' ' 509' ' ' PCW . 15.2 tpt180 -63.89 -44.19 93.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.429 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.7 m -65.35 -34.51 78.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.828 0.347 . . . . 10.0 111.11 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -76.28 -37.03 58.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.837 0.351 . . . . 10.0 110.087 179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 101.34 27.31 7.31 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 121.172 -0.537 . . . . 10.0 112.262 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -118.83 146.92 41.19 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 120.331 0.11 . . . . 10.0 110.879 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.448 ' HG2' HG13 ' B' ' 112' ' ' VAL . 91.7 Cg_endo -82.85 147.86 13.57 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.287 1.991 . . . . 10.0 112.053 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.514 ' HE2' HG23 ' B' ' 127' ' ' THR . 38.9 t80 -117.54 124.56 49.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.563 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 40.8 mm -115.38 121.67 67.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.24 -0.436 . . . . 10.0 110.585 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.3 113.46 25.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.642 -0.873 . . . . 10.0 108.642 179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -140.37 179.72 6.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.45 0.537 . . . . 10.0 112.45 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.8 t -152.77 141.2 20.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.498 -0.774 . . . . 10.0 108.923 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.422 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -77.09 -29.96 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.785 -0.821 . . . . 10.0 108.785 179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -67.19 -48.17 68.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.071 -0.968 . . . . 10.0 110.196 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.2 m -78.31 -41.22 34.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.299 -0.41 . . . . 10.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 149' ' ' ARG . 1.7 ttt180 60.75 48.62 6.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.233 0.539 . . . . 10.0 112.136 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -119.73 101.42 7.89 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 120.993 0.425 . . . . 10.0 110.088 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 109.94 -10.76 32.01 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.733 -0.746 . . . . 10.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 16.8 t -69.17 -33.22 57.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.316 0.579 . . . . 10.0 110.025 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.39 -44.31 91.75 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.471 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.76 -20.55 39.02 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.678 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -58.22 -45.94 86.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.142 0.496 . . . . 10.0 109.731 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . 0.54 ' HE1' HG21 ' B' ' 55' ' ' ILE . 8.1 m-85 -69.3 -32.5 71.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.866 178.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -66.05 -39.19 89.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.656 178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 30.4 m -58.37 -43.74 88.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 10.0 110.566 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.722 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.8 tp -60.79 -46.47 90.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.528 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.69 -39.22 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.829 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' B' ' 161' ' ' ARG . 61.4 mtt180 -62.67 -37.55 86.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.193 -0.458 . . . . 10.0 111.375 179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -71.88 -33.93 68.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.891 0.377 . . . . 10.0 110.336 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.483 HG22 ' HE2' ' B' ' 167' ' ' LYS . 96.6 mt -67.11 -40.42 85.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.479 . . . . 10.0 110.484 179.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.469 HH22 ' HB2' ' B' ' 49' ' ' GLU . 21.2 mtt180 -58.64 -40.41 83.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.659 -0.7 . . . . 10.0 110.612 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -75.88 -32.89 59.9 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.993 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -61.47 -41.8 97.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.533 . . . . 10.0 110.469 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.483 ' HE2' HG22 ' B' ' 163' ' ' ILE . 68.6 mttm -65.32 -43.88 89.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.108 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -65.37 -40.51 93.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.146 -0.479 . . . . 10.0 109.757 179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -60.12 -48.17 82.83 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.778 -0.647 . . . . 10.0 110.729 179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 24.2 mmt -63.15 -29.03 70.47 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.983 0.421 . . . . 10.0 111.54 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 18.6 m -73.78 -39.93 63.8 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.111 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 47.5 mtmt -83.23 -33.42 26.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.844 0.354 . . . . 10.0 111.352 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' B' ' 176' ' ' LYS . 11.8 t70 -68.22 -49.22 62.21 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.605 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 63.53 -101.53 0.46 Allowed Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.632 -0.587 . . . . 10.0 111.632 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 33.2 mttp -134.06 14.22 3.91 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.935 0.398 . . . . 10.0 110.648 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' B' ' 173' ' ' ASP . 0.0 OUTLIER -114.34 112.04 22.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.785 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -141.41 167.78 21.35 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.388 -0.597 . . . . 10.0 109.388 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? 73.26 119.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.284 0.564 . . . . 10.0 111.714 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -100.2 111.61 23.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 10.0 110.943 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . 0.436 ' NZ ' ' O4 ' ' A' ' 410' ' ' 17F . 20.3 tptp -90.15 92.2 8.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.215 0.531 . . . . 10.0 110.88 179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 11.1 m -136.85 142.01 42.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.616 -0.72 . . . . 10.0 109.9 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.411 ' NZ ' HN1A ' A' ' 410' ' ' 17F . 37.6 mtmm -88.49 -28.69 20.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.588 0.218 . . . . 10.0 111.588 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 25.4 m 72.75 118.81 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 O-C-N 123.706 0.629 . . . . 10.0 111.314 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.524 ' HA ' ' H63' ' A' ' 410' ' ' 17F . 81.8 tttt 63.79 74.49 0.41 Allowed 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.7 0.762 . . . . 10.0 110.851 -178.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.912 ' HB3' ' H18' ' A' ' 410' ' ' 17F . 14.9 t . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.066 -0.97 . . . . 10.0 110.447 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 35.8 t30 . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 120.888 0.375 . . . . 10.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 2.3 p -128.67 105.8 8.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.326 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.2 tp -97.23 124.21 49.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.223 0.535 . . . . 10.0 110.681 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.433 ' HG2' HG22 ' D' ' 369' ' ' VAL . 0.8 OUTLIER -83.69 96.83 8.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.929 -0.578 . . . . 10.0 111.293 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 22.4 t -89.56 104.48 15.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.015 0.436 . . . . 10.0 109.897 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -89.71 150.48 22.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.165 0.507 . . . . 10.0 111.455 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 6.4 mp -111.25 172.59 3.42 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.385 -0.825 . . . . 10.0 108.811 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.719 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 37.6 Cg_endo -65.23 148.14 88.52 Favored 'Trans proline' 0 C--O 1.238 0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 112.343 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 30.2 t-20 71.05 -87.82 0.03 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.302 -0.863 . . . . 10.0 111.73 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -154.97 99.47 2.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.05 0.453 . . . . 10.0 110.999 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.897 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.0 OUTLIER -174.24 139.34 0.61 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.156 -1.053 . . . . 10.0 108.156 -179.947 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . 0.42 ' HG3' ' OG ' ' B' ' 39' ' ' SER . 8.2 ptt85 -147.87 139.92 24.16 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.826 -0.349 . . . . 10.0 111.566 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.666 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 22.5 m -137.71 106.13 5.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.339 179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.694 HG23 ' HB3' ' B' ' 37' ' ' GLU . 48.6 t -83.35 111.35 19.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 32.9 m -100.74 156.37 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.023 0.439 . . . . 10.0 111.65 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.835 ' HB2' HD11 ' B' ' 36' ' ' ILE . 55.4 t30 -105.0 101.51 11.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.965 -0.562 . . . . 10.0 109.788 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . 0.443 HG11 ' SG ' ' D' ' 381' ' ' CYS . 17.1 m -110.87 134.73 52.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.084 0.468 . . . . 10.0 112.001 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' D' ' 373' ' ' ARG . 0.0 OUTLIER -139.77 -179.3 5.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 10.0 110.004 179.299 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 72.81 -48.87 0.69 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.283 0.633 . . . . 10.0 112.561 178.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 138.91 107.39 0.75 Allowed Glycine 0 N--CA 1.445 -0.702 0 N-CA-C 111.14 -0.784 . . . . 10.0 111.14 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.0 mtt -139.37 150.45 45.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.776 0.322 . . . . 10.0 110.255 -179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 43.3 m -88.88 164.73 15.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' D' ' 382' ' ' LEU . 48.7 mt -52.32 -45.8 65.75 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.083 0.401 . . . . 10.0 112.083 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -58.99 -32.87 70.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 10.0 112.027 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -60.2 -48.48 81.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.141 0.496 . . . . 10.0 111.152 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . 0.443 ' SG ' HG11 ' D' ' 372' ' ' VAL . 0.8 OUTLIER -72.82 -32.31 65.42 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.395 179.586 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' D' ' 378' ' ' LEU . 50.6 mt -67.17 -39.6 86.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.264 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 23.9 ttp -59.46 -32.57 70.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 10.0 111.036 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -58.63 -47.1 85.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.224 -0.443 . . . . 10.0 111.569 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.38 -25.33 29.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.646 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 30.2 tp -57.03 -48.08 79.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.774 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -66.91 -25.48 66.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.684 ' CG1' HD13 ' B' ' 21' ' ' ILE . 96.8 t -78.69 -47.44 23.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.225 0.536 . . . . 10.0 110.123 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 15.8 mmt180 -70.24 -38.82 75.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.756 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 77.31 65.69 1.9 Allowed Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.234 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 98.5 mt -136.74 -176.95 4.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.707 0.289 . . . . 10.0 110.552 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -114.01 125.5 29.3 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.396 -0.366 . . . . 10.0 110.099 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.1 0.02 6.52 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.299 2.666 . . . . 10.0 113.958 -178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -79.76 -31.23 40.91 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.137 -0.352 . . . . 10.0 111.163 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 13.0 m -90.23 -5.06 56.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.887 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . 0.432 ' HB3' HG12 ' D' ' 428' ' ' VAL . 30.3 m -97.31 145.37 26.18 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.078 -0.51 . . . . 10.0 111.593 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -127.52 129.34 47.21 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.005 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.65 119.45 33.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.443 0.534 . . . . 10.0 112.443 -178.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.519 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 77.7 m-85 -120.35 146.45 46.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 10.0 109.212 179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 12.8 ptm180 -105.31 -178.88 3.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.805 0.336 . . . . 10.0 111.699 -179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 22.1 tp -65.55 132.79 49.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.83 -0.623 . . . . 10.0 109.851 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.88 124.35 19.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.862 0.363 . . . . 10.0 111.963 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -107.79 78.58 1.2 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.097 -0.502 . . . . 10.0 111.042 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 60.99 47.05 7.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.58 -0.736 . . . . 10.0 111.581 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -96.89 163.44 12.97 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.257 -0.429 . . . . 10.0 110.534 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -67.33 -46.87 72.2 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.197 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 176.23 24.03 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.491 -0.861 . . . . 10.0 112.929 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -124.95 132.4 53.28 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 122.596 -0.355 . . . . 10.0 110.832 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.519 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.0 pttt -69.12 138.21 54.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.325 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . 0.43 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -81.36 128.37 33.76 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.74 0.305 . . . . 10.0 110.789 -179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -85.11 137.91 32.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.219 -0.446 . . . . 10.0 111.387 -179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 7.7 mt -115.74 -163.03 0.86 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.287 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -106.75 -173.23 2.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.527 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 73.1 m95 -105.03 -22.78 13.05 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.772 0.32 . . . . 10.0 111.072 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -97.67 13.45 30.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.058 0.456 . . . . 10.0 111.503 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.483 ' HB ' ' HG ' ' D' ' 378' ' ' LEU . 2.1 m -67.25 136.47 54.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.82 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -72.97 130.04 39.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.093 0.473 . . . . 10.0 110.907 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -69.52 -31.07 69.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.619 -178.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.19 -26.3 66.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.032 0.444 . . . . 10.0 111.303 -179.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 18.7 m -75.23 -10.21 59.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.071 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.3 mp -114.45 29.52 7.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.079 0.466 . . . . 10.0 110.552 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 10.4 tt -59.65 110.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 121.342 0.591 . . . . 10.0 111.233 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 102.36 1.25 50.63 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.683 -0.77 . . . . 10.0 113.135 179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -92.94 168.32 11.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.813 0.34 . . . . 10.0 111.333 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -123.82 88.98 3.01 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-O 121.083 0.468 . . . . 10.0 109.905 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . . . . . . . . . 3.0 tp -80.48 141.29 35.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.282 -179.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -130.66 132.82 45.65 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.013 0.435 . . . . 10.0 111.164 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.432 HG12 ' HB3' ' D' ' 396' ' ' CYS . 21.9 t -104.14 104.87 17.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.108 -0.496 . . . . 10.0 109.81 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -99.53 -171.53 2.08 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.511 -0.768 . . . . 10.0 110.19 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -108.37 150.63 27.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 10.0 111.062 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.8 pp -107.32 -175.64 2.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.315 -0.402 . . . . 10.0 111.224 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.2 72.6 2.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.241 0.543 . . . . 10.0 112.004 -179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -124.17 -68.92 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.103 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 6.4 t -125.44 98.49 34.89 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.12 -0.491 . . . . 10.0 109.979 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -86.11 161.74 10.1 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.848 2.365 . . . . 10.0 112.384 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 68.54 -178.9 0.22 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.685 -0.689 . . . . 10.0 112.234 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 4.7 m -132.83 137.75 46.84 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.735 -0.666 . . . . 10.0 109.326 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.97 168.75 9.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.79 0.329 . . . . 10.0 111.804 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -79.18 119.09 21.77 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.935 -0.575 . . . . 10.0 109.83 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -92.26 130.36 37.97 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.439 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -86.41 118.32 25.77 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.353 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -121.93 134.34 54.84 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.179 0.514 . . . . 10.0 111.067 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -107.11 99.72 9.25 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.024 -0.534 . . . . 10.0 111.513 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 8.1 ptmt -155.28 165.2 37.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.867 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.8 p -81.15 -178.79 7.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.346 0.593 . . . . 10.0 112.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -112.59 150.76 30.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 10.0 109.842 179.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . 0.649 ' O ' ' H63' ' B' ' 207' ' ' PCW . 7.1 mp -82.01 -79.82 0.17 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.173 -0.306 . . . . 10.0 110.173 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . 0.536 ' HG3' ' C3 ' ' B' ' 213' ' ' 17F . 28.4 ttmt -86.49 146.27 26.47 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.739 -0.467 . . . . 10.0 109.739 179.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . 0.516 HD13 ' H11' ' B' ' 207' ' ' PCW . 58.8 tp -55.87 128.15 33.69 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.501 0.501 . . . . 10.0 111.439 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -131.68 160.01 36.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.762 -0.654 . . . . 10.0 109.283 179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 62.7 m-85 -104.28 161.18 14.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 110.221 -0.289 . . . . 10.0 110.221 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.704 ' HA ' HD23 ' D' ' 459' ' ' LEU . 16.1 t -75.05 147.46 40.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.29 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.85 -20.01 20.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.627 0.727 . . . . 10.0 109.649 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' D' ' 476' ' ' CYS . 31.5 mm -95.16 -47.17 13.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.986 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -93.35 -168.04 1.83 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 10.0 109.913 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -120.6 18.02 12.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.148 0.499 . . . . 10.0 109.791 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -114.0 179.73 3.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.514 -179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . 0.422 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 5.2 p90 -75.34 158.27 33.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.251 0.548 . . . . 10.0 111.492 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.781 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.1 OUTLIER -95.64 104.13 16.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.941 -0.572 . . . . 10.0 109.94 179.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.451 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -83.11 -146.2 0.08 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 10.0 109.616 179.172 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.451 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 2.8 p-10 -75.63 60.63 1.27 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.116 0.484 . . . . 10.0 111.171 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -89.97 -133.57 5.24 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.174 -0.536 . . . . 10.0 111.885 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -126.93 153.01 46.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.81 0.338 . . . . 10.0 111.266 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' D' ' 470' ' ' TYR . 8.7 ptm180 -150.98 144.52 24.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.744 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -83.0 156.08 23.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.206 0.527 . . . . 10.0 111.999 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -90.42 -41.03 11.69 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.319 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 -65.62 0.83 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.42 -0.809 . . . . 10.0 110.772 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.457 ' CB ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -70.84 -71.59 0.24 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.846 -179.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 112.43 36.4 1.61 Allowed Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.386 -0.911 . . . . 10.0 113.156 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . 0.502 ' O ' ' HA ' ' D' ' 464' ' ' ARG . 1.2 t80 -89.79 150.06 22.43 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.131 -0.322 . . . . 10.0 110.131 179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.781 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 15.4 pttp -114.84 129.4 56.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.399 -0.364 . . . . 10.0 111.173 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.898 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 17.8 p90 -156.38 166.51 33.21 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 55.5 m80 -94.86 -173.58 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.065 -0.346 . . . . 10.0 110.065 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -69.16 -27.37 65.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.163 0.506 . . . . 10.0 110.789 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 7.0 m80 -84.96 -28.73 25.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.793 -0.64 . . . . 10.0 111.13 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.898 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 1.4 m -81.82 -15.5 53.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.873 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 51.1 m -45.98 -54.51 8.22 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 112.915 0.709 . . . . 10.0 112.915 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.45 9.26 29.73 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.217 0.532 . . . . 10.0 110.987 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.47 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 62.5 tttm -85.32 -33.28 22.12 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.1 p -69.23 118.01 57.74 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.823 -0.626 . . . . 10.0 111.169 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -83.59 -12.76 8.71 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.503 2.135 . . . . 10.0 111.543 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.74 98.98 10.87 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.274 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 60.9 tpp -62.26 143.86 56.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.749 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.457 ' HB3' ' CB ' ' D' ' 468' ' ' CYS . 61.1 m -64.73 106.36 1.18 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.421 -0.354 . . . . 10.0 111.866 -179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 6.7 t -141.94 151.75 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -153.01 139.49 18.66 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.374 -0.232 . . . . 10.0 110.374 179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 38.8 p90 . . . . . 0 C--N 1.323 -0.552 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.697 -179.629 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 0.939 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 1.002 ' H52' ' H1 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 0.968 H231 H162 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.216 ' H31' ' O1P' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.111 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 1.015 H411 H361 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 0.997 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.07 H172 H212 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.053 ' H60' H432 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.966 ' H53' H281 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.037 ' H39' H151 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 1.056 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.063 ' H39' H432 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 1.086 H272 H461 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.036 H341 H141 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.047 H122 ' H11' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 0.996 H242 H242 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 1.006 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.0 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.116 ' H2 ' ' C4 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.008 H461 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.007 ' O31' ' H51' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.052 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.044 H261 ' H62' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.088 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.912 ' H63' ' O1 ' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.017 ' C6 ' H321 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.063 H432 ' H39' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.007 ' H51' ' O31' ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 0.929 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.153 H141 ' H9A' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.07 ' H19' H461 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.07 H461 ' H19' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.12 H412 ' H45' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 0.955 H432 H472 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 1.088 ' H2 ' ' H41' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.063 H262 ' H61' ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.063 ' H61' H262 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.051 H232 H481 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.071 H412 ' H39' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.071 ' H39' H412 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.025 H142 H151 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.066 ' H73' H271 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.058 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 1.048 ' H39' ' H47' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 1.044 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.047 ' H11' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.12 ' H45' H412 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.153 ' H9A' H141 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 0.928 ' C31' H352 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.059 H161 H322 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.047 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.013 H471 H442 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.004 H241 H282 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.185 H283 ' C23' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 0.945 H342 H172 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.025 H262 H222 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.927 ' O11' ' H82' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 0.997 H361 ' H12' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.041 ' H20' H242 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.005 H352 ' H9A' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.081 H11A H412 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.022 ' H4 ' ' H52' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.03 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.767 H5'1 ' HD1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.051 H481 H232 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.013 H442 H471 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.026 H352 ' H82' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.091 H421 ' C16' ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.11 H252 H212 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.041 H242 ' H20' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.08 H351 ' H9 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.086 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.049 ' H62' ' H2 ' ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.035 ' O11' ' H51' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.001 H19A ' H57' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.111 ' H47' ' H42' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.08 ' H9 ' H351 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.111 ' H42' ' H47' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.0 H483 H211 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.043 H161 H162 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . 0.56 HD22 HD12 ' A' ' 204' ' ' LEU . 79.0 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.916 0.388 . . . . 10.0 110.754 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 28.8 tttm -60.92 -36.5 79.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.953 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.545 HD21 H282 ' A' ' 415' ' ' PCW . 31.0 mt -72.42 -22.0 61.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.275 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . 0.56 HD12 HD22 ' A' ' 201' ' ' LEU . 92.0 mt -90.66 -41.54 11.26 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.962 0.411 . . . . 10.0 110.456 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -72.0 -47.61 50.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.74 -0.663 . . . . 10.0 111.538 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 202' ' ' LYS . 0.9 OUTLIER -73.65 -10.64 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.917 0.389 . . . . 10.0 111.931 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . 0.468 ' HB2' ' O ' ' A' ' 203' ' ' LEU . 40.6 t90 -71.92 -31.69 66.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.048 -1.093 . . . . 10.0 108.048 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -64.66 -30.26 71.27 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 114.886 -1.052 . . . . 10.0 110.11 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.64 -28.06 68.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 121.238 0.542 . . . . 10.0 109.992 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 24.9 t -79.04 -44.09 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 108.707 -0.849 . . . . 10.0 108.707 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 13.2 m -65.29 -39.88 93.1 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.704 -0.68 . . . . 10.0 111.237 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 26.0 p -62.97 -40.18 96.93 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 109.654 -0.498 . . . . 10.0 109.654 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 47.9 m -65.84 -43.61 87.99 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.152 -0.684 . . . . 10.0 109.152 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . 0.461 ' HZ ' H161 ' A' ' 402' ' ' PCW . 0.6 OUTLIER -59.19 -42.76 91.64 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.057 -0.52 . . . . 10.0 110.645 179.417 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 35.9 m -60.98 -46.4 90.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.682 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 35.8 mttt -69.17 -32.04 71.09 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.889 0.376 . . . . 10.0 110.806 179.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.54 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 35.3 mt -65.48 -45.85 82.04 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 108.513 -0.921 . . . . 10.0 108.513 177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -38.89 87.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.675 -0.693 . . . . 10.0 109.773 178.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -59.97 -52.81 63.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.5 -0.773 . . . . 10.0 109.96 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -64.35 -34.88 79.17 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.498 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 26.5 mt -54.85 -31.82 59.91 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.987 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.19 -73.59 0.43 Allowed Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.485 -1.046 . . . . 10.0 110.485 178.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.15 -39.2 81.01 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.371 2.047 . . . . 10.0 111.105 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 3.2 t -55.95 -51.11 64.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 116.587 -0.279 . . . . 10.0 111.388 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.7 p -65.83 -38.15 88.12 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.74 0.305 . . . . 10.0 111.156 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -62.44 -49.17 76.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 10.0 110.274 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -70.55 -43.78 68.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.783 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' A' ' 232' ' ' LEU . 10.3 t80 -61.83 -53.01 61.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.665 -0.243 . . . . 10.0 111.146 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.534 ' CH2' H462 ' A' ' 402' ' ' PCW . 1.7 m-90 -64.48 -31.33 72.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.776 0.322 . . . . 10.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -66.82 -44.61 80.72 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.777 -0.823 . . . . 10.0 108.777 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.858 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 65.2 m-20 -68.23 -35.83 78.54 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.832 178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 228' ' ' PHE . 60.0 mt -64.62 -38.39 90.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 9.1 mm-40 -67.77 -32.53 73.19 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.707 -0.679 . . . . 10.0 111.105 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 57.8 mttt -66.95 -34.9 78.78 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.47 -0.937 . . . . 10.0 108.47 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.46 -47.22 43.2 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.056 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 9.6 p -63.68 -36.79 84.99 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.35 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 233' ' ' GLU . 1.4 tt0 -61.54 -44.47 96.99 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 108.888 -0.782 . . . . 10.0 108.888 178.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.75 -39.89 97.94 Favored Glycine 0 N--CA 1.448 -0.553 0 N-CA-C 110.196 -1.162 . . . . 10.0 110.196 178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 70.1 mt -66.63 -35.04 79.23 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 10.0 110.239 178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 243' ' ' MET . 49.1 mtt180 -70.22 -37.59 75.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.906 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 70.0 mt-30 -72.07 -36.05 69.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -76.36 -11.81 59.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.492 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.732 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.4 ttm -63.83 -35.5 80.84 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.632 -0.877 . . . . 10.0 108.632 178.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.461 ' C ' ' HB2' ' A' ' 248' ' ' GLU . 0.7 OUTLIER -75.34 4.93 6.31 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.22 -0.9 . . . . 10.0 110.39 179.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -121.2 -60.29 1.65 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.829 -0.804 . . . . 10.0 108.829 178.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.546 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.3 OUTLIER -59.65 -66.0 0.59 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.155 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.732 HD12 ' HG3' ' A' ' 243' ' ' MET . 74.0 mt -69.84 -30.28 67.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.604 0.594 . . . . 10.0 112.604 -178.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.461 ' HB2' ' C ' ' A' ' 244' ' ' SER . 1.6 mm-40 -72.73 -58.18 3.54 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.105 0.409 . . . . 10.0 112.105 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -63.36 -33.73 76.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.614 -0.266 . . . . 10.0 111.498 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.773 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.1 p -66.55 -25.18 34.44 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.073 0 C-N-CA 120.787 -0.365 . . . . 10.0 111.191 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.526 ' O ' HG12 ' A' ' 254' ' ' VAL . 84.1 mttt -92.24 -39.69 11.39 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.073 0.463 . . . . 10.0 110.272 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -65.61 -40.9 93.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.217 0.532 . . . . 10.0 110.4 179.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 29.3 mtpt -83.3 -21.7 33.16 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.864 -0.607 . . . . 10.0 111.689 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.773 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.7 OUTLIER -64.5 -26.01 39.27 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.754 -0.378 . . . . 10.0 110.597 -179.641 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 39.6 mt-30 -59.37 -63.38 4.26 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 115.881 -0.6 . . . . 10.0 110.379 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 37.7 Cg_endo -68.1 -30.7 31.35 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 121.703 1.602 . . . . 10.0 111.482 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.433 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 4.3 m-30 -60.51 -57.47 12.6 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.844 0.354 . . . . 10.0 110.198 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.418 ' HG ' HG22 ' A' ' 254' ' ' VAL . 35.1 mt -69.75 -32.57 71.17 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.787 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 263' ' ' LYS . 25.4 t70 -59.33 -43.75 92.7 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.006 0.431 . . . . 10.0 109.946 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -71.27 -48.85 48.38 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.687 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.408 ' HD1' ' HA ' ' A' ' 261' ' ' PHE . 3.1 m-30 -58.43 -46.96 85.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.945 -0.571 . . . . 10.0 111.249 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -66.55 -40.23 88.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.513 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 19.5 ttmt -58.72 -46.25 87.79 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.559 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 72.2 mttt -69.59 -40.82 76.45 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.956 178.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -58.65 -44.42 90.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.172 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 270' ' ' GLU . 45.0 mt-30 -62.11 -46.97 86.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.235 179.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.8 -38.12 86.9 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.307 -0.627 . . . . 10.0 109.307 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.453 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 30.4 mt-10 -63.91 -40.29 96.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.676 -0.693 . . . . 10.0 110.186 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 79.7 mmm -67.36 -41.07 85.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.545 -0.752 . . . . 10.0 109.801 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 266' ' ' GLN . 11.3 mm-40 -66.33 -40.46 89.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.701 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.4 mt -64.54 -36.99 86.02 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.95 -0.759 . . . . 10.0 108.95 178.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.52 -49.03 72.88 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 108.874 -0.787 . . . . 10.0 108.874 178.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.648 ' HA ' HG12 ' A' ' 276' ' ' VAL . 40.2 mtt180 -60.94 -48.11 83.34 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.068 -0.514 . . . . 10.0 111.087 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -24.79 55.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.628 -0.714 . . . . 10.0 112.169 -179.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.624 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 5.2 mptt -104.43 -41.29 5.79 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.091 0.404 . . . . 10.0 112.091 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 273' ' ' ARG . 4.2 p -56.22 -33.06 36.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 113.243 0.831 . . . . 10.0 113.243 -178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 28.4 mt-10 -68.48 -60.74 4.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.61 -0.436 . . . . 10.0 112.077 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.25 -36.0 82.05 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 121.778 1.652 . . . . 10.0 111.945 178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 55.1 mt -66.6 -38.31 86.71 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.675 0.274 . . . . 10.0 110.505 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -63.18 -37.62 87.93 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -63.92 -43.61 95.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.817 -0.629 . . . . 10.0 109.563 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 80.7 mt-10 -62.72 -45.5 92.46 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.875 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 74.0 mt -65.06 -39.06 92.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.535 -0.757 . . . . 10.0 110.826 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -69.95 -45.0 68.39 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.176 -0.305 . . . . 10.0 110.176 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -65.61 -38.61 89.94 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.392 -0.596 . . . . 10.0 109.392 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -66.9 -42.5 92.79 Favored Glycine 0 N--CA 1.443 -0.874 0 N-CA-C 110.126 -1.19 . . . . 10.0 110.126 178.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.52 -37.5 83.93 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -57.66 -48.07 80.51 Favored 'General case' 0 C--O 1.224 -0.239 0 O-C-N 123.364 0.415 . . . . 10.0 110.191 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -67.99 -44.09 77.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.682 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 67.0 mttt -61.32 -41.97 97.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.146 0.498 . . . . 10.0 110.448 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 79.6 mt -70.29 -40.66 74.16 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.982 -0.553 . . . . 10.0 110.434 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -61.28 -38.14 85.67 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.678 -0.49 . . . . 10.0 109.678 178.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 297' ' ' LYS . 2.7 tp10 -61.7 -42.17 98.57 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.886 -0.783 . . . . 10.0 108.886 178.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 89.4 mt -70.59 -36.38 73.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.492 -0.776 . . . . 10.0 110.877 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.3 -37.42 87.18 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.286 -0.635 . . . . 10.0 109.286 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -74.05 -0.59 16.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.717 -0.674 . . . . 10.0 111.293 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 293' ' ' GLU . 32.7 mmtt -113.5 -43.22 3.35 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.508 -0.552 . . . . 10.0 109.508 178.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.455 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 75.2 mt -64.99 -24.56 67.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.708 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.525 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.7 m -77.42 -63.43 0.49 Allowed Pre-proline 0 CA--C 1.544 0.728 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 36.3 Cg_endo -66.04 -52.12 1.0 Allowed 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 121.727 1.618 . . . . 10.0 111.903 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.665 HD13 ' HG2' ' C' ' 473' ' ' LYS . 57.0 mt -69.3 -27.68 65.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.639 -0.255 . . . . 10.0 111.102 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -70.56 -51.97 18.37 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.811 -0.916 . . . . 10.0 110.811 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.39 -34.25 77.86 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -67.96 -42.93 80.14 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 18.1 tpt -60.12 -42.51 94.94 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 62.0 mtt180 -62.62 -43.61 98.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.375 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -65.93 -45.63 81.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.463 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -64.94 -32.4 74.1 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.619 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -68.37 -32.66 72.9 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.264 -0.426 . . . . 10.0 109.892 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' A' ' 314' ' ' ASP . 74.3 mtt180 -59.16 -51.95 67.78 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.731 -0.841 . . . . 10.0 108.731 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.6 -35.62 77.6 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.62 -0.718 . . . . 10.0 110.124 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 0.0 OUTLIER -53.02 -56.16 18.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.921 -0.582 . . . . 10.0 109.879 178.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 38.9 t -76.89 -32.08 19.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.51 -0.768 . . . . 10.0 111.672 -179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.535 ' HB2' ' O ' ' A' ' 310' ' ' ARG . 1.8 t70 -62.03 -47.92 82.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.84 0.352 . . . . 10.0 110.619 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.34 -38.47 89.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.97 -0.752 . . . . 10.0 108.97 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.36 -47.95 79.97 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.773 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 31.9 ttm105 -60.31 -43.41 96.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.534 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 19.0 m -60.53 -30.44 69.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.244 -0.435 . . . . 10.0 110.268 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 27.2 m80 -82.5 -41.56 19.57 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 93.0 mt -64.02 -22.55 66.98 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.481 -0.781 . . . . 10.0 112.194 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.428 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -59.58 -62.83 5.07 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-O 119.776 -0.154 . . . . 10.0 111.235 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 30.4 Cg_endo -67.45 -26.49 40.65 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.195 1.263 . . . . 10.0 110.727 178.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.514 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 14.1 m-30 -63.61 -50.9 67.57 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.073 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 12.7 p -66.28 -36.83 83.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.053 0.454 . . . . 10.0 110.008 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -60.7 -48.47 81.66 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.596 -0.729 . . . . 10.0 109.852 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -75.21 -25.48 58.21 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.785 -0.643 . . . . 10.0 111.061 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.03 -35.95 82.39 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.802 -0.814 . . . . 10.0 108.802 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 324' ' ' SER . 65.1 mtt180 -65.69 -41.17 92.7 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.565 -0.902 . . . . 10.0 108.565 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -64.91 -40.93 95.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.714 -0.676 . . . . 10.0 109.855 179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 330' ' ' ARG . 50.3 mtt-85 -63.11 -48.23 79.44 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.429 -0.582 . . . . 10.0 109.429 178.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 42.4 mt -62.14 -45.7 92.28 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.516 -0.766 . . . . 10.0 110.191 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -58.87 -44.48 91.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.931 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -61.95 -51.5 67.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.038 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 69.1 mtt-85 -63.19 -45.02 93.67 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.577 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 339' ' ' LYS . 29.0 mt -59.11 -40.01 84.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.829 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.3 -40.0 38.11 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.065 0.228 . . . . 10.0 111.492 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.68 -46.93 87.6 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 52.8 mt -73.78 -12.68 60.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.799 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.553 ' HB2' ' O ' ' A' ' 335' ' ' LEU . 23.6 tttt -79.61 -49.47 12.13 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.109 -0.7 . . . . 10.0 109.109 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.08 -49.54 67.23 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.803 -0.814 . . . . 10.0 108.803 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 29.6 t-20 -63.24 -39.66 95.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.495 -0.775 . . . . 10.0 109.577 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -64.42 -44.04 95.89 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.246 -0.742 . . . . 10.0 111.246 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.77 99.66 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.656 -0.978 . . . . 10.0 110.656 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.8 91.17 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.422 -0.584 . . . . 10.0 109.422 178.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.417 ' HG2' ' OD1' ' C' ' 429' ' ' ASN . 30.5 mtm180 -61.32 -47.19 87.09 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.393 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 77.9 mt -59.99 -43.98 94.8 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.335 0.397 . . . . 10.0 110.892 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -62.32 -46.12 90.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 109.727 -0.472 . . . . 10.0 109.727 178.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.486 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 25.1 mt-10 -64.95 -38.05 89.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.732 -0.667 . . . . 10.0 110.298 178.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . 0.421 ' HD2' ' HA ' ' A' ' 349' ' ' TYR . 5.4 m-30 -63.99 -37.11 86.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 178.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -63.87 -45.61 88.64 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.865 -0.791 . . . . 10.0 108.865 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 355' ' ' GLU . . . -62.81 -49.31 75.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.31 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 16.2 mttm -61.04 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.478 . . . . 10.0 111.347 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 357' ' ' LEU . . . -65.98 -33.84 76.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 10.0 110.331 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 51.6 m -64.79 -48.35 74.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.052 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 351' ' ' ALA . 37.9 mm-40 -65.14 -29.98 70.87 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.447 -0.575 . . . . 10.0 109.447 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.78 -27.05 65.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.641 -0.709 . . . . 10.0 109.743 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 353' ' ' ALA . 92.8 mt -78.73 -40.28 34.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.851 -0.613 . . . . 10.0 109.443 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.57 -41.42 94.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.049 178.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 2.3 p -77.49 -26.97 51.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.29 0.567 . . . . 10.0 109.7 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 57.1 tp -65.96 -32.9 74.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.84 -0.8 . . . . 10.0 108.84 178.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 13.9 m -63.85 -27.03 68.89 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.259 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -71.34 -23.23 61.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.674 0.75 . . . . 10.0 109.489 178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.52 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 61.2 mttt -92.52 -40.22 10.94 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.336 -0.847 . . . . 10.0 109.367 178.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -72.43 -27.45 62.34 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.669 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 80.3 mttt -108.05 -77.3 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 53.3 Cg_exo -53.56 -52.13 9.27 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.205 1.937 . . . . 10.0 113.329 -179.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.05 -56.39 17.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.722 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 368' ' ' LEU . 11.5 mt -57.83 -41.71 82.86 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.007 0.373 . . . . 10.0 112.007 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -63.03 -50.06 72.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 110.244 -0.28 . . . . 10.0 110.244 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.12 -37.56 83.24 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.837 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.8 mt -68.03 -45.23 74.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.563 -0.744 . . . . 10.0 110.356 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 72.9 mtt180 -63.49 -47.47 81.63 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.88 0.372 . . . . 10.0 110.2 179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -64.61 -33.38 75.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.982 -0.554 . . . . 10.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 378' ' ' VAL . . . -79.38 -26.58 56.96 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.83 -0.623 . . . . 10.0 112.359 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 25.5 mt -78.06 -23.21 48.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.835 0.309 . . . . 10.0 111.835 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 75.7 mt -56.3 -57.98 19.48 Favored Pre-proline 0 CA--C 1.532 0.251 0 N-CA-C 111.775 0.287 . . . . 10.0 111.775 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.72 -23.46 74.53 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 122.045 1.83 . . . . 10.0 111.079 178.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 374' ' ' GLY . 77.7 t -70.57 -48.32 59.66 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 N-CA-C 109.226 -0.657 . . . . 10.0 109.226 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 88.7 mt -63.48 -29.88 71.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.819 -0.628 . . . . 10.0 109.481 179.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.07 -55.58 18.03 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.583 -0.735 . . . . 10.0 110.64 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.6 p -65.73 -37.55 86.7 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.211 -0.45 . . . . 10.0 110.386 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -61.74 -41.34 97.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.452 178.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 17.4 mtmt -62.05 -49.63 75.19 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.452 179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.49 -49.04 81.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.178 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 15.0 m -63.24 -37.63 87.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.358 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.33 -46.86 69.07 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.313 -0.403 . . . . 10.0 110.787 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 96.9 mt -60.47 -45.84 92.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.476 . . . . 10.0 111.112 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.435 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 2.9 p -66.37 -34.87 78.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.428 -0.351 . . . . 10.0 110.833 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.17 -39.55 94.97 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 88.0 mt -63.79 -41.69 97.88 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 45.0 mt-10 -61.91 -44.24 97.2 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.774 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 388' ' ' SER . 52.3 mm-40 -56.39 -52.79 63.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.639 -0.709 . . . . 10.0 111.772 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -62.21 -40.03 94.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.477 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 30.1 m -66.22 -46.67 76.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.871 0.367 . . . . 10.0 111.393 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -59.67 -34.71 73.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.939 0.718 . . . . 10.0 112.939 -179.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -103.63 4.28 35.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 114.414 1.265 . . . . 10.0 114.414 -177.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.4 5.93 6.31 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.261 0.467 . . . . 10.0 112.261 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 34.2 t30 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.886 179.754 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.376 0.608 . . . . 10.0 110.219 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? -102.99 20.86 16.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.389 -0.823 . . . . 10.0 109.428 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.84 -35.43 80.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.289 -0.869 . . . . 10.0 110.901 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.3 mt -61.04 -43.33 99.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.24 0.543 . . . . 10.0 109.57 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.39 -42.51 87.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.534 -0.757 . . . . 10.0 109.806 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.528 ' O ' HG23 ' C' ' 408' ' ' VAL . 21.3 t-20 -62.41 -48.01 81.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.099 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -59.93 -38.14 81.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.902 -0.59 . . . . 10.0 110.951 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.13 -50.06 74.8 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.256 178.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 2.0 m -61.04 -37.3 82.12 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.802 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.528 HG23 ' O ' ' C' ' 404' ' ' ASN . 50.0 t -68.56 -38.2 78.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 59.8 m -64.31 -34.34 77.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.426 -0.583 . . . . 10.0 109.426 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 5.9 m -60.1 -49.05 79.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.671 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.93 -37.58 87.6 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.305 178.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . 0.563 ' O ' ' HG3' ' C' ' 416' ' ' ARG . 9.6 m-30 -63.52 -44.47 94.16 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.117 0.484 . . . . 10.0 109.833 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 17.9 m -65.96 -42.59 89.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.746 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' C' ' 414' ' ' LYS . 24.2 mmtm -63.23 -31.18 72.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.37 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 0.5 OUTLIER -68.86 -38.09 79.52 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.738 -0.838 . . . . 10.0 108.738 178.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' C' ' 412' ' ' PHE . 74.9 mtt180 -67.32 -37.39 83.24 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -65.6 -20.44 66.31 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.505 -0.771 . . . . 10.0 109.978 178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -88.97 -50.86 5.92 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.737 -0.838 . . . . 10.0 108.737 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 95.1 mt -45.44 -49.49 13.3 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.323 -0.853 . . . . 10.0 112.685 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.72 -75.0 0.25 Allowed Glycine 0 CA--C 1.523 0.533 0 C-N-CA 121.148 -0.548 . . . . 10.0 112.853 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . 0.496 ' O ' ' HG2' ' C' ' 425' ' ' GLU . 72.1 Cg_exo -53.63 -40.2 80.25 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.901 2.401 . . . . 10.0 112.57 179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 29.6 t -61.4 -47.56 92.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 112.031 0.382 . . . . 10.0 112.031 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 23.6 p -65.28 -36.64 84.72 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.809 -0.356 . . . . 10.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -61.21 -44.22 97.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.09 -0.504 . . . . 10.0 110.605 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' C' ' 421' ' ' PRO . 12.5 pt-20 -81.06 -22.29 39.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.128 0.489 . . . . 10.0 110.29 179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -70.71 -42.82 70.1 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 8.0 m95 -64.63 -41.3 96.26 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.799 -0.815 . . . . 10.0 108.799 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.8 t70 -63.21 -32.22 73.56 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.689 178.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.417 ' OD1' ' HG2' ' A' ' 345' ' ' ARG . 7.3 t30 -76.87 -43.18 37.02 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.313 -0.625 . . . . 10.0 109.313 178.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.44 -36.12 77.46 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.297 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -60.6 -43.71 97.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.768 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 45.2 mttp -64.13 -42.02 96.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.564 -0.744 . . . . 10.0 109.252 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' C' ' 437' ' ' LEU . 28.2 mt-10 -65.52 -56.81 10.33 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.693 -0.685 . . . . 10.0 111.316 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 10.0 p -55.45 -52.84 62.28 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 123.194 0.309 . . . . 10.0 111.532 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.14 -40.24 97.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.658 0.266 . . . . 10.0 111.216 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.94 -43.62 95.7 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.778 -0.929 . . . . 10.0 110.778 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' C' ' 433' ' ' GLU . 89.2 mt -66.08 -31.98 73.17 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.988 -0.375 . . . . 10.0 109.988 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 56.5 mtt180 -66.33 -31.01 71.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.223 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -65.0 -46.43 81.46 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.917 -0.772 . . . . 10.0 108.917 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 33.6 mt-10 -67.93 -38.41 82.85 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 10.0 109.318 178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . 0.47 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 69.3 mmm -62.79 -43.77 97.93 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.003 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 5.4 p -65.64 -43.06 90.62 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.89 0.376 . . . . 10.0 110.084 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -73.76 -9.79 59.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.015 -0.539 . . . . 10.0 110.306 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.595 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 3.8 t0 -93.83 -53.44 4.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.978 -0.555 . . . . 10.0 109.697 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.8 -51.03 60.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.724 -0.671 . . . . 10.0 112.396 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -61.7 -33.1 73.41 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.014 0.435 . . . . 10.0 110.927 -179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -26.05 29.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.127 -0.488 . . . . 10.0 109.814 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.595 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.5 OUTLIER -67.14 -30.33 49.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.304 179.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.37 -31.85 73.18 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 177.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -91.56 10.98 25.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.54 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.512 ' HD2' H283 ' C' ' 601' ' ' PCW . 31.1 mmtm -117.66 -54.31 2.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.169 179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . . . . . . . . . 87.7 t -60.06 -45.15 95.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.607 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -56.67 -59.8 11.23 Favored Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 112.766 0.654 . . . . 10.0 112.766 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.83 -32.86 45.18 Favored 'Trans proline' 0 C--N 1.352 0.718 0 C-N-CA 121.77 1.646 . . . . 10.0 111.926 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 42.5 t80 -63.56 -48.57 76.9 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.657 -0.497 . . . . 10.0 109.657 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 32.1 mt -67.25 -34.82 78.25 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.243 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -67.09 -45.02 78.5 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.109 0.48 . . . . 10.0 110.467 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -66.78 -40.19 88.09 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.918 -0.583 . . . . 10.0 109.621 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.17 -41.22 86.34 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.518 -0.764 . . . . 10.0 110.349 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -60.67 -40.47 92.21 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.7 -0.482 . . . . 10.0 109.7 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 57.7 mttt -61.51 -44.83 96.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.808 ' HB3' H281 ' C' ' 602' ' ' PCW . 1.7 mtmm -66.83 -36.66 82.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.407 178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -65.33 -41.16 94.23 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.809 -0.811 . . . . 10.0 108.809 177.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -64.15 -41.97 96.97 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 108.956 -0.757 . . . . 10.0 108.956 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.672 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 36.0 mt-10 -57.74 -55.01 40.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 115.704 -0.68 . . . . 10.0 109.242 178.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -58.8 -39.3 80.7 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.44 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.11 -47.39 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 10.0 109.925 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -62.57 -41.37 98.89 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.411 -0.589 . . . . 10.0 109.411 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 69.7 mt -65.02 -40.11 94.39 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.54 -0.754 . . . . 10.0 110.923 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -64.13 -35.42 80.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.877 0.37 . . . . 10.0 110.611 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.87 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 87.9 mtt180 -68.86 -21.61 64.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.233 0.54 . . . . 10.0 110.266 179.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -108.25 6.38 26.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.133 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.665 ' HG2' HD13 ' A' ' 301' ' ' LEU . 50.4 mttp -127.36 -69.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.704 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 47.9 t -62.21 -42.95 97.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.48 -0.327 . . . . 10.0 111.46 -179.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 8.3 mt-10 -59.93 -58.18 21.27 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 112.557 0.577 . . . . 10.0 112.557 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.8 -38.51 48.27 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.405 1.403 . . . . 10.0 110.57 178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' C' ' 477' ' ' LEU . 11.7 mt -60.22 -35.59 75.8 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 109.752 -0.462 . . . . 10.0 109.752 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 37.2 mtt180 -60.06 -36.01 76.38 Favored 'General case' 0 N--CA 1.456 -0.147 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -74.42 -50.33 18.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.978 -0.556 . . . . 10.0 110.216 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.79 -42.27 98.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.734 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.74 -32.91 71.72 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.657 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.556 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 9.0 tt0 -70.7 -35.24 72.67 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.548 -0.908 . . . . 10.0 108.548 178.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.86 -45.04 79.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.179 -1.045 . . . . 10.0 108.179 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -66.22 -30.48 76.85 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.22 -47.14 71.75 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 71.6 mtt180 -60.26 -37.66 81.11 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -63.65 -51.97 62.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.368 -0.833 . . . . 10.0 109.3 178.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.537 ' O ' ' HG ' ' C' ' 492' ' ' LEU . 87.9 tttt -60.28 -41.2 92.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.858 -0.61 . . . . 10.0 110.097 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 84.0 mt -61.33 -46.61 89.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.954 178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -60.93 -46.15 91.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.542 -0.54 . . . . 10.0 109.542 179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 69.7 mt-10 -61.29 -37.64 83.91 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.544 -0.753 . . . . 10.0 110.096 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' C' ' 488' ' ' LYS . 79.3 mt -71.66 -44.43 64.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.618 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -58.61 -38.75 78.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.976 0.417 . . . . 10.0 110.554 179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.97 -7.93 32.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.634 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.431 ' HE3' HD22 ' A' ' 279' ' ' LEU . 27.6 mttp -115.03 -39.37 3.67 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.969 0.414 . . . . 10.0 110.082 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.423 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 78.4 mt -63.58 -23.15 67.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 10.0 111.791 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.836 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 10.7 m -85.03 -64.34 0.23 Allowed Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 116.642 -0.254 . . . . 10.0 111.623 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.836 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.5 Cg_exo -63.56 -55.89 0.62 Allowed 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.988 1.792 . . . . 10.0 111.536 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.47 HD21 ' HG2' ' A' ' 275' ' ' LYS . 63.7 mt -66.68 -29.89 70.01 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.514 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.423 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -61.99 -50.93 60.75 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.467 -1.053 . . . . 10.0 110.467 178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -69.24 -37.45 77.98 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.62 -0.511 . . . . 10.0 109.62 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 25.9 tt0 -57.64 -49.89 74.96 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.048 -0.524 . . . . 10.0 109.59 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.673 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.4 mmm -62.16 -41.42 98.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.52 179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -65.58 -36.79 84.8 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.586 179.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 14.2 t0 -69.91 -34.95 74.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.836 -0.62 . . . . 10.0 109.653 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.673 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 49.0 mtt180 -63.89 -45.21 90.39 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 107.77 -1.196 . . . . 10.0 107.77 177.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -57.77 -37.07 73.02 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 115.08 -0.964 . . . . 10.0 110.158 178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.581 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 89.0 mtt180 -62.23 -43.43 98.85 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.242 -0.651 . . . . 10.0 109.242 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.559 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.71 -32.58 74.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.519 -0.764 . . . . 10.0 110.9 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.48 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 60.8 m-70 -80.86 -43.54 19.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.734 0.302 . . . . 10.0 110.638 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.413 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 42.3 t -63.81 -43.05 97.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.812 0.339 . . . . 10.0 110.355 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.473 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 24.5 t70 -67.0 -35.89 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.612 -0.514 . . . . 10.0 109.612 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.86 -41.74 97.71 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.665 ' HA ' ' HB2' ' C' ' 517' ' ' HIS . 68.3 mt -62.72 -27.6 69.38 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.279 -0.419 . . . . 10.0 110.647 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.473 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 84.2 mtt180 -68.65 -20.82 64.48 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.311 -0.626 . . . . 10.0 109.311 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.52 3.43 18.05 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.73 . . . . 10.0 109.266 178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.665 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 25.9 m170 -116.49 -70.03 0.82 Allowed 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.75 -0.659 . . . . 10.0 111.134 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . 0.428 ' HG ' HD22 ' C' ' 514' ' ' LEU . 73.3 mt -69.69 -49.83 49.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.89 -179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.65 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -52.58 -57.98 13.64 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 112.847 0.684 . . . . 10.0 112.847 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.65 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.8 Cg_exo -62.86 -39.41 41.78 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.931 1.754 . . . . 10.0 111.569 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.9 t80 -63.65 -36.19 83.01 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 116.664 -0.244 . . . . 10.0 111.135 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 28.4 m -63.69 -34.52 78.04 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.75 -0.463 . . . . 10.0 109.75 178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.578 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 9.1 t0 -73.38 -39.79 64.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.047 -0.524 . . . . 10.0 110.141 179.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.67 -35.65 79.26 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.792 -0.818 . . . . 10.0 108.792 178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.507 HD23 ' HD2' ' C' ' 528' ' ' ARG . 13.1 mt -67.63 -31.43 71.45 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.405 -0.816 . . . . 10.0 109.973 178.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.578 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 64.3 mtt180 -57.69 -35.48 70.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.515 -0.311 . . . . 10.0 110.441 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' C' ' 527' ' ' GLN . 15.0 mt-30 -66.11 -44.88 83.03 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.341 -0.615 . . . . 10.0 109.341 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 58.6 mtt180 -67.05 -41.53 86.35 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.406 -0.816 . . . . 10.0 109.86 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 85.2 mt -62.69 -41.69 99.25 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.467 -0.568 . . . . 10.0 109.467 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.096 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -41.89 85.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.364 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -63.81 -46.98 82.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.743 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 62.1 mt -63.64 -35.0 79.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.877 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -63.23 -45.34 92.06 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.939 -0.573 . . . . 10.0 109.638 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.53 -42.97 95.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.318 -0.623 . . . . 10.0 109.318 178.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . . . . . . . . . 96.8 mt -65.43 -27.79 68.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.901 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 87.2 mttt -79.51 -44.72 20.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.041 178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . 0.402 ' HA ' ' OE2' ' C' ' 538' ' ' GLU . 4.7 tp10 -63.51 -52.9 59.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.831 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -69.39 -31.22 69.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.0 -0.545 . . . . 10.0 109.688 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.437 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -44.27 86.71 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.939 -0.865 . . . . 10.0 110.939 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -64.13 -39.22 96.95 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 110.453 -1.059 . . . . 10.0 110.453 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.15 79.22 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.898 -0.779 . . . . 10.0 108.898 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 47.6 mtt85 -60.31 -38.57 84.1 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.686 -0.688 . . . . 10.0 110.227 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 68.8 mt -62.92 -41.99 99.65 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.97 -0.381 . . . . 10.0 109.97 178.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.11 -44.09 85.29 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.018 -0.734 . . . . 10.0 109.018 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.628 ' O ' ' HD2' ' C' ' 550' ' ' LYS . 76.5 mt-10 -63.91 -42.76 97.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.564 -0.744 . . . . 10.0 110.186 178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.97 -48.31 78.69 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.393 -0.595 . . . . 10.0 109.393 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -61.07 -44.11 97.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.135 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -60.37 -52.33 65.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.284 -0.417 . . . . 10.0 110.594 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.628 ' HD2' ' O ' ' C' ' 546' ' ' GLU . 0.0 OUTLIER -63.54 -37.06 85.88 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.311 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.05 91.49 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 110.059 -0.349 . . . . 10.0 110.059 179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 19.5 m -65.82 -41.72 91.46 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.492 -0.558 . . . . 10.0 109.492 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 41.7 mt-10 -66.39 -41.43 89.39 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.387 0.613 . . . . 10.0 109.713 178.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -67.56 -40.61 84.93 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.163 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 41.7 tp -62.46 -45.02 94.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.264 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 4.4 p -67.29 -40.53 86.09 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.178 -0.465 . . . . 10.0 111.234 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 15.2 p -70.09 -29.21 66.12 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.839 0.352 . . . . 10.0 110.092 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.846 HD21 H281 ' A' ' 402' ' ' PCW . 14.6 mt -65.78 -51.26 60.54 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.987 -0.552 . . . . 10.0 109.647 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 4.4 p -68.8 -39.18 80.25 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.957 0.408 . . . . 10.0 110.248 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -54.85 -38.97 68.13 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.606 -0.725 . . . . 10.0 110.946 179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.51 -34.64 17.34 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.185 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.38 92.45 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -54.9 -62.03 4.86 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.175 0.435 . . . . 10.0 112.175 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.98 -29.93 33.37 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.7 1.6 . . . . 10.0 112.045 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.49 -55.19 22.36 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 110.207 -0.294 . . . . 10.0 110.207 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 72.9 mt -61.94 -33.81 74.95 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.986 0.422 . . . . 10.0 110.368 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -54.79 26.43 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.847 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -62.01 -39.91 93.88 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.475 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 30.4 mt -54.94 -50.39 68.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.144 -0.48 . . . . 10.0 110.151 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 -69.88 -38.64 76.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 121.028 -0.269 . . . . 10.0 111.302 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.52 -20.59 66.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.659 0.266 . . . . 10.0 111.037 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -99.09 -38.51 3.79 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.136 -0.786 . . . . 10.0 111.136 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' C' ' 577' ' ' LEU . 56.6 mt -63.82 -32.84 74.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.516 0.191 . . . . 10.0 111.516 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 65.9 mt -61.19 -63.05 4.77 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.645 0.609 . . . . 10.0 112.645 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.23 -32.44 82.35 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.825 1.683 . . . . 10.0 111.262 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 6.6 t -68.86 -40.16 80.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.316 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.812 HD22 ' HE3' ' C' ' 581' ' ' LYS . 0.5 OUTLIER -61.74 -46.73 88.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.718 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.403 ' O ' HG23 ' C' ' 582' ' ' VAL . 20.3 mm-40 -62.03 -45.38 93.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.668 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 20.2 m -65.04 -37.08 86.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.123 178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.57 -41.49 92.84 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.566 -0.531 . . . . 10.0 109.566 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . 0.812 ' HE3' HD22 ' C' ' 577' ' ' LEU . 86.2 mttt -60.11 -38.65 83.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.141 -0.688 . . . . 10.0 109.141 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.403 HG23 ' O ' ' C' ' 578' ' ' GLU . 53.4 t -62.08 -52.39 61.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.853 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.41 -38.55 91.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.494 -0.321 . . . . 10.0 111.342 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -65.58 -49.41 68.92 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.83 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.85 -48.13 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.629 -0.26 . . . . 10.0 111.616 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 7.5 p -59.94 -29.96 68.75 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.385 0.612 . . . . 10.0 111.049 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -76.97 -51.54 10.96 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.621 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.6 mt -57.68 -48.81 78.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.842 -0.617 . . . . 10.0 111.306 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 66.0 mt-10 -54.7 -49.1 71.52 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 123.335 0.397 . . . . 10.0 111.332 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' C' ' 593' ' ' LYS . 22.3 mt-10 -69.3 -29.36 67.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.475 -0.33 . . . . 10.0 111.724 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -63.2 -43.75 97.28 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.102 -0.332 . . . . 10.0 110.102 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -17.11 63.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 10.0 111.593 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.402 ' HD2' ' HA ' ' C' ' 590' ' ' GLU . 94.9 mttt -86.85 -38.8 16.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 10.0 109.998 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.435 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.6 mptt -77.65 -30.96 52.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.224 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 68.6 mt -101.89 25.7 8.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.743 -0.662 . . . . 10.0 110.178 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.772 -0.649 . . . . 10.0 111.265 -179.522 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.2 mmt . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 120.677 0.275 . . . . 10.0 110.343 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 1.8 m -83.83 127.23 33.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.166 -179.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.423 ' HA ' ' O ' ' B' ' 52' ' ' LEU . 78.6 tt0 -92.11 144.94 24.92 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.136 0.421 . . . . 10.0 112.136 -179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -133.59 140.2 47.0 Favored 'General case' 0 C--O 1.233 0.184 0 N-CA-C 109.309 -0.626 . . . . 10.0 109.309 178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -98.18 120.21 38.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.445 0.164 . . . . 10.0 110.632 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' B' ' 55' ' ' ILE . 9.6 mt -131.4 120.32 22.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.421 0.526 . . . . 10.0 112.421 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 88.2 t -110.33 133.56 55.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 1.6 m -96.25 135.43 30.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.036 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.419 HG11 HD11 ' B' ' 100' ' ' ILE . 24.3 m -121.06 149.15 24.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.661 -0.245 . . . . 10.0 111.417 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 161.07 171.37 26.97 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.977 -0.63 . . . . 10.0 111.869 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.61 -174.88 4.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.893 0.378 . . . . 10.0 111.115 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.29 138.11 14.79 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.611 -0.804 . . . . 10.0 112.358 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . 0.449 ' N ' ' O2B' ' B' ' 216' ' ' GNP . . . 89.1 32.27 10.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 121.342 -0.456 . . . . 10.0 112.255 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.89 -39.94 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 113.939 1.088 . . . . 10.0 113.939 -178.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.705 ' HA2' ' H8 ' ' B' ' 216' ' ' GNP . . . 120.93 24.51 2.5 Favored Glycine 0 CA--C 1.507 -0.439 0 N-CA-C 111.43 -0.668 . . . . 10.0 111.43 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.763 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 19.0 ttpp -66.72 -50.19 63.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.564 -0.318 . . . . 10.0 110.446 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 62.5 m -73.05 -32.96 65.39 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.227 0.537 . . . . 10.0 110.561 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.49 -49.46 77.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.511 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 50.0 mt -59.55 -35.69 74.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.437 . . . . 10.0 111.07 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 5.4 m -63.42 -56.12 18.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.281 -0.418 . . . . 10.0 111.591 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 19.9 mt -66.33 -38.69 82.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.737 0.303 . . . . 10.0 111.437 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 22.9 tp60 -66.59 -26.89 67.32 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.192 0.812 . . . . 10.0 113.192 -178.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -88.46 -47.81 8.07 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 112.349 0.5 . . . . 10.0 112.349 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.8 -64.06 0.99 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.494 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 -178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 59.5 mm-40 -79.06 -17.57 54.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.603 -178.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 93.9 m-20 66.29 35.95 5.63 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.378 0.609 . . . . 10.0 110.628 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -122.46 145.07 48.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.575 -0.739 . . . . 10.0 110.294 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -115.76 126.16 53.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.083 -0.34 . . . . 10.0 110.083 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.6 m -79.13 171.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.39 -0.368 . . . . 10.0 111.297 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -119.94 -57.91 1.92 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.403 . . . . 10.0 110.627 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.34 150.31 33.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.89 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.44 117.45 29.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.872 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' B' ' 34' ' ' PRO . 16.5 t70 -126.65 123.53 23.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.741 -0.663 . . . . 10.0 110.087 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' B' ' 33' ' ' ASP . 31.4 Cg_exo -60.18 126.63 20.68 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.971 2.448 . . . . 10.0 112.328 -179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.73 131.25 34.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.746 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' D' ' 370' ' ' VAL . 26.4 mt -99.41 -55.51 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 109.299 -0.63 . . . . 10.0 109.299 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.847 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 20.4 tt0 -158.38 123.81 4.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.382 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -151.0 136.27 17.66 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.461 -179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 14.9 m -124.37 129.35 50.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.517 -0.31 . . . . 10.0 111.477 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -126.88 137.32 53.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.751 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 41' ' ' ARG . 0.0 OUTLIER -146.9 134.65 21.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.509 -0.314 . . . . 10.0 111.255 -179.053 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -144.73 162.78 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.312 -0.404 . . . . 10.0 109.991 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' D' ' 468' ' ' CYS . 8.6 mt-30 -94.11 118.17 31.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.234 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 3.2 m -127.05 144.9 35.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.65 0.262 . . . . 10.0 111.248 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.01 70.2 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.014 0.435 . . . . 10.0 111.291 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.407 HD11 HD11 ' B' ' 53' ' ' LEU . 62.7 mt -66.0 99.97 0.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.382 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 64.84 40.17 5.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.187 -0.915 . . . . 10.0 112.066 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 98.56 -56.57 1.01 Allowed Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.826 -0.625 . . . . 10.0 113.617 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -70.37 132.92 46.37 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.842 0.353 . . . . 10.0 111.597 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 2.3 m -73.06 123.29 23.27 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.431 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 5.4 m -121.37 152.84 38.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.386 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.423 ' O ' ' HA ' ' B' ' 3' ' ' GLU . 11.7 tp -115.35 109.23 17.6 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.535 -0.913 . . . . 10.0 108.535 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.481 HD22 HD11 ' B' ' 6' ' ' LEU . 56.4 mt -96.02 117.64 31.06 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 112.533 0.568 . . . . 10.0 112.533 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -96.75 98.55 10.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' B' ' 6' ' ' LEU . 75.7 mt -102.05 124.35 55.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.745 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.2 tp -114.5 118.89 35.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.678 -0.692 . . . . 10.0 110.194 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -75.66 160.85 29.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.92 -0.582 . . . . 10.0 109.805 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.53 175.16 8.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.698 0.285 . . . . 10.0 110.563 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -95.0 105.0 16.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.584 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.39 -29.71 75.83 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.8 -0.714 . . . . 10.0 112.367 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -100.4 70.88 1.52 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.884 0.373 . . . . 10.0 111.058 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.599 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 35.3 tt0 -160.03 161.35 33.98 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.209 -0.663 . . . . 10.0 109.209 -179.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -97.17 -158.76 0.69 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.541 -0.3 . . . . 10.0 110.471 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -73.95 106.26 5.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.124 0.488 . . . . 10.0 110.405 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 2.8 p -110.09 146.35 35.55 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.868 -0.606 . . . . 10.0 110.852 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.27 80.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.08 0.467 . . . . 10.0 110.998 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 31.3 mmm -65.93 -36.75 84.23 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.472 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.622 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 16.9 ttm180 -61.19 -49.35 77.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.677 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.42 -26.71 65.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.073 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -66.51 -65.86 0.63 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.911 -0.586 . . . . 10.0 111.262 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.622 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.6 p90 -68.55 -27.69 66.31 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.174 0.805 . . . . 10.0 113.174 -178.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.744 ' HE3' HG21 ' B' ' 103' ' ' VAL . 15.0 ttp -67.43 -24.38 65.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 10.0 110.462 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 38.5 ttm105 -82.07 -23.79 35.6 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.922 -0.581 . . . . 10.0 110.302 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 m -78.94 -29.5 44.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.841 -0.618 . . . . 10.0 111.358 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.52 156.05 53.25 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.162 -0.542 . . . . 10.0 112.703 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.05 -63.8 1.34 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.759 0.314 . . . . 10.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.21 128.89 9.53 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.638 -0.792 . . . . 10.0 111.726 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.857 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 97.5 m-85 -112.16 116.65 30.81 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.234 0.54 . . . . 10.0 112.29 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.796 ' HG ' HD22 ' B' ' 159' ' ' LEU . 8.0 mt -98.12 119.87 37.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.435 178.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.481 ' HB2' HD12 ' B' ' 113' ' ' LEU . 2.8 m -93.53 98.24 11.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.048 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 14.2 m -97.97 128.86 48.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.108 -0.496 . . . . 10.0 111.009 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.589 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 27.8 p90 -141.14 160.69 39.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.619 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.477 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -94.61 123.85 38.3 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.516 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.897 HD11 ' HA ' ' B' ' 118' ' ' CYS . 44.3 pt -76.24 -3.54 5.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 112.311 0.486 . . . . 10.0 112.311 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.517 ' HB2' ' HB2' ' B' ' 122' ' ' SER . 6.3 p-10 -93.16 3.04 56.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.263 0.554 . . . . 10.0 110.305 179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.434 HD21 ' HB3' ' B' ' 88' ' ' LYS . 40.9 t30 -137.82 126.57 23.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.797 -0.638 . . . . 10.0 109.818 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.94 -29.02 63.85 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.434 ' HB3' HD21 ' B' ' 86' ' ' ASN . 48.1 tttp -58.94 -43.41 91.19 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.644 0.259 . . . . 10.0 111.464 -179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.589 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -57.73 -33.62 68.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.169 -0.468 . . . . 10.0 111.437 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -69.21 -34.5 74.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.571 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -77.91 -34.27 51.49 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.878 0.371 . . . . 10.0 110.724 179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.72 -22.23 66.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.284 -0.417 . . . . 10.0 111.914 -179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 37.6 mm -52.59 -52.12 29.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.179 -0.464 . . . . 10.0 112.035 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.521 ' HD2' ' HG2' ' B' ' 98' ' ' GLU . 1.8 t60 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.416 -0.357 . . . . 10.0 111.321 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -58.39 -49.17 78.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.995 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -70.31 -31.18 68.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.838 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -62.45 -50.91 69.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.212 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.521 ' HG2' ' HD2' ' B' ' 94' ' ' HIS . 66.0 mm-40 -64.85 -30.73 71.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.879 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.578 ' O ' HG23 ' B' ' 103' ' ' VAL . 34.8 tt0 -64.89 -50.91 64.71 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.317 -0.623 . . . . 10.0 109.317 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.419 HD11 HG11 ' B' ' 9' ' ' VAL . 85.8 mt -59.72 -41.6 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.697 -0.683 . . . . 10.0 110.574 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' B' ' 107' ' ' GLU . 44.5 mtpt -56.06 -37.5 69.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.277 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 44.8 ttp85 -76.16 -45.49 33.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.081 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.744 HG21 ' HE3' ' B' ' 72' ' ' MET . 43.3 t -57.13 -52.63 53.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.215 -0.448 . . . . 10.0 111.803 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -80.67 -13.77 58.73 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.255 -0.43 . . . . 10.0 111.031 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t70 60.34 30.42 19.81 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.845 0.831 . . . . 10.0 110.778 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 6.4 m -142.45 128.88 20.1 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.356 -0.838 . . . . 10.0 110.669 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.4 ' HA ' ' HG2' ' B' ' 101' ' ' LYS . 6.1 mt-10 -82.89 -22.95 33.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.739 -0.837 . . . . 10.0 108.739 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -93.82 80.68 4.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.993 -1.003 . . . . 10.0 109.377 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -126.07 146.02 54.28 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.691 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.7 95.86 0.65 Allowed 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.806 2.337 . . . . 10.0 112.26 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.857 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 72.8 mtm -125.66 141.77 51.85 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.514 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.682 ' HB ' HD23 ' B' ' 79' ' ' LEU . 45.0 t -127.7 146.52 33.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.368 -0.605 . . . . 10.0 109.368 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 80' ' ' CYS . 15.7 tp -100.48 124.01 45.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 10.0 110.574 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.457 HG22 ' HB ' ' B' ' 142' ' ' ILE . 41.2 t -125.72 121.71 60.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.02 0.438 . . . . 10.0 111.763 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.11 112.21 4.42 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.513 -1.035 . . . . 10.0 110.513 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.412 ' ND2' ' N7 ' ' B' ' 216' ' ' GNP . 61.5 t30 -94.61 169.06 10.45 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 116.646 0.223 . . . . 10.0 111.054 -178.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.633 ' HB3' HD12 ' B' ' 120' ' ' LEU . 98.7 mttt 62.16 35.66 15.49 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.417 0.627 . . . . 10.0 111.545 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.897 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.4 p -75.97 -17.01 59.89 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.877 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -82.1 -9.21 59.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 10.0 111.246 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.633 HD12 ' HB3' ' B' ' 117' ' ' LYS . 86.1 mt -79.05 140.95 57.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.203 -0.453 . . . . 10.0 110.585 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -73.82 11.93 1.03 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.974 2.449 . . . . 10.0 113.309 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.517 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.0 OUTLIER -104.51 27.55 7.79 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.877 0.37 . . . . 10.0 110.373 179.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 30.3 ttm-85 -56.34 99.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.678 -0.692 . . . . 10.0 111.511 -179.223 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 16.9 m -98.3 -52.24 3.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.755 -0.657 . . . . 10.0 111.069 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.31 116.05 9.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.817 -0.438 . . . . 10.0 109.817 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.733 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 25.3 t70 -73.18 140.38 46.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.489 . . . . 10.0 111.501 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 5.1 m -55.08 -44.41 74.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.971 -0.559 . . . . 10.0 112.134 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' B' ' 132' ' ' ASP . 55.8 tttm -66.28 -35.81 81.35 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.791 -0.186 . . . . 10.0 111.241 -179.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.733 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 54.9 mt-30 -60.2 -46.6 89.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.837 0.351 . . . . 10.0 110.579 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.74 -43.53 68.69 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.178 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -62.92 -47.05 84.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.446 -0.343 . . . . 10.0 111.882 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 0.3 OUTLIER -61.65 -39.33 90.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.181 0.515 . . . . 10.0 110.581 179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 22.6 tp -66.71 -49.97 64.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.912 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.31 -45.83 90.23 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.839 -0.619 . . . . 10.0 111.515 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -60.53 -32.01 71.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 10.0 110.919 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 49.9 m -72.83 -26.81 61.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.552 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -96.89 -8.27 31.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.967 0.413 . . . . 10.0 111.218 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 83.0 32.47 26.27 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.998 -0.62 . . . . 10.0 113.057 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 23.3 pt -126.44 151.59 72.92 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.305 -0.257 . . . . 10.0 110.305 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.566 ' HG2' HG13 ' B' ' 112' ' ' VAL . 86.2 Cg_endo -87.48 151.83 7.74 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.657 2.238 . . . . 10.0 112.603 179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -116.86 129.71 56.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.441 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.457 ' HB ' HG22 ' B' ' 114' ' ' VAL . 42.3 mm -125.69 112.89 32.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.692 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -81.43 124.13 29.17 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.389 -0.967 . . . . 10.0 108.389 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.26 176.09 9.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.36 0.6 . . . . 10.0 112.588 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 3.3 t -155.03 131.0 10.13 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.3 -0.864 . . . . 10.0 109.263 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -77.01 -30.86 56.03 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.224 0.535 . . . . 10.0 109.713 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.496 ' HD3' HN21 ' B' ' 216' ' ' GNP . 27.8 tttm -69.9 -32.45 70.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.271 -0.877 . . . . 10.0 110.873 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 3.5 m -93.65 -32.19 14.17 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.148 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 43.8 ttt-85 60.81 37.48 18.65 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.113 -0.494 . . . . 10.0 111.723 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -111.82 113.29 25.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.242 -0.435 . . . . 10.0 111.007 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 92.44 -0.3 71.02 Favored Glycine 0 CA--C 1.517 0.195 0 C-N-CA 120.922 -0.656 . . . . 10.0 113.552 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 19.4 t -63.38 -36.89 77.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.247 0.546 . . . . 10.0 110.49 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -59.34 -54.86 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.484 -0.78 . . . . 10.0 111.045 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . 0.623 ' OD2' ' H52' ' B' ' 212' ' ' PCW . 8.0 t70 -67.52 -30.2 69.8 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.585 0.587 . . . . 10.0 112.585 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.47 88.1 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.303 0.573 . . . . 10.0 110.207 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -80.05 -40.77 27.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.206 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.406 ' HB2' ' HA ' ' B' ' 154' ' ' ASP . 4.3 m-85 -60.8 -40.11 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.032 -0.531 . . . . 10.0 111.537 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . 0.496 ' OG1' ' H63' ' B' ' 212' ' ' PCW . 90.0 m -59.49 -40.59 87.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.878 179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.796 HD22 ' HG ' ' B' ' 79' ' ' LEU . 39.1 tp -60.45 -44.3 95.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 10.0 110.369 179.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.407 HG11 HD13 ' B' ' 46' ' ' ILE . 57.0 t -66.4 -41.74 89.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.475 . . . . 10.0 110.234 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.452 ' NH1' ' H51' ' B' ' 212' ' ' PCW . 59.9 mtt180 -62.04 -37.72 86.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.459 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -61.47 -38.06 85.87 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.394 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.606 HG22 ' HE2' ' B' ' 167' ' ' LYS . 63.9 mt -66.38 -41.07 88.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.721 178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -64.68 -39.6 93.96 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.415 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.916 ' HB3' ' H61' ' B' ' 209' ' ' PCW . 73.1 mttt -66.62 -37.05 84.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 10.0 110.051 179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -61.4 -50.54 72.46 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.791 -0.64 . . . . 10.0 110.135 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.606 ' HE2' HG22 ' B' ' 163' ' ' ILE . 61.0 mttm -61.44 -39.73 91.89 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.948 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -68.22 -45.49 73.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.058 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.24 -43.74 92.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.592 -0.731 . . . . 10.0 111.084 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 25.9 mmt -62.63 -23.67 67.2 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.243 0.46 . . . . 10.0 112.243 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.9 m -77.12 -17.59 58.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.782 0.325 . . . . 10.0 111.734 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . . . . . . . . . 40.8 mtmt -113.05 -48.48 2.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 10.0 111.125 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . 0.416 ' OD2' ' HB3' ' B' ' 176' ' ' LYS . 32.5 t70 -70.01 -39.39 75.88 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 10.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 82.14 -83.07 1.57 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 110.994 -0.843 . . . . 10.0 110.994 -179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . 0.409 ' HA ' ' HD3' ' B' ' 175' ' ' LYS . 1.4 tppm? -161.45 43.42 0.16 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.641 0.734 . . . . 10.0 109.544 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.43 ' HB3' ' HE2' ' B' ' 176' ' ' LYS . 33.6 ttpt -102.84 84.8 2.44 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.287 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 2.7 mmpm? -84.06 61.44 6.47 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.585 0.707 . . . . 10.0 111.235 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -111.75 80.2 1.3 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.216 -0.902 . . . . 10.0 109.459 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 52.4 tttt -86.44 105.68 16.93 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.43 -0.805 . . . . 10.0 110.4 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -153.47 96.09 1.99 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.458 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . 0.462 ' OG ' ' H2 ' ' B' ' 201' ' ' PCW . 26.8 p -151.49 -106.96 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.24 -0.437 . . . . 10.0 110.921 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.993 ' HD3' ' H40' ' B' ' 201' ' ' PCW . 24.1 tttm -158.66 105.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.799 -179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.66 -50.64 66.26 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.076 0.465 . . . . 10.0 111.22 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -158.95 -55.64 0.06 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.949 -0.569 . . . . 10.0 110.082 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.238 0.487 0 O-C-N 123.834 0.709 . . . . 10.0 110.819 -179.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 60.7 t30 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.77 0.319 . . . . 10.0 110.509 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . 0.477 ' H ' HG13 ' D' ' 422' ' ' ILE . 4.1 m -143.27 137.89 29.2 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.43 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.7 tp -148.73 134.21 11.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.937 0.399 . . . . 10.0 110.868 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.571 ' HD3' ' HE1' ' D' ' 361' ' ' PHE . 24.8 mtt180 -100.05 98.55 9.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.402 -0.363 . . . . 10.0 110.955 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . 0.477 ' HB ' ' O ' ' D' ' 368' ' ' THR . 59.8 t -86.29 112.7 23.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.621 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . 0.571 ' HE1' ' HD3' ' D' ' 359' ' ' ARG . 10.4 m-85 -106.99 135.47 48.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.318 0.58 . . . . 10.0 111.831 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.988 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 7.9 mp -108.32 173.03 3.24 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.718 -0.845 . . . . 10.0 108.718 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.583 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 82.8 Cg_exo -48.57 156.25 1.93 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.75 2.3 . . . . 10.0 113.269 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 59.2 t30 69.94 -86.88 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.203 -0.908 . . . . 10.0 111.422 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -162.09 27.75 0.11 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.903 0.382 . . . . 10.0 111.73 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.988 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 17.7 tp60 -77.47 126.45 30.92 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.963 -0.384 . . . . 10.0 109.963 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . 0.487 ' HB3' ' CE2' ' D' ' 361' ' ' PHE . 8.1 ptt180 -125.67 95.8 4.56 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.011 0.434 . . . . 10.0 111.926 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.477 ' O ' ' HB ' ' D' ' 360' ' ' VAL . 1.0 OUTLIER -100.74 93.71 5.7 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.627 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.847 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 2.2 m -83.64 116.89 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.921 0.391 . . . . 10.0 110.631 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . 0.705 ' HA ' HD12 ' B' ' 36' ' ' ILE . 15.8 m -121.28 -179.53 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.39 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -131.42 122.61 26.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.736 -0.211 . . . . 10.0 110.599 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . 0.53 HG11 ' SG ' ' D' ' 381' ' ' CYS . 30.9 m -113.57 166.61 7.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.514 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 2.1 tpp85 -162.55 177.72 9.21 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 123.374 0.421 . . . . 10.0 109.988 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 73.29 -75.62 0.07 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.976 0.798 . . . . 10.0 112.612 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . 179.55 65.79 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.914 -0.66 . . . . 10.0 111.876 -179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 63.8 mtt -101.2 137.32 39.7 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.185 0.517 . . . . 10.0 111.22 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -94.29 177.94 5.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.375 178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . . . . . . . . . 45.6 mt -60.52 -44.57 95.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.847 0.356 . . . . 10.0 110.73 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -55.84 -40.04 72.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.79 -0.641 . . . . 10.0 111.846 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.72 -58.09 9.93 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.21 -0.45 . . . . 10.0 111.387 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . 0.53 ' SG ' HG11 ' D' ' 372' ' ' VAL . 2.6 m -60.4 -43.4 96.7 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.634 -0.712 . . . . 10.0 112.354 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.39 -31.88 73.26 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.448 0.536 . . . . 10.0 112.448 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 17.3 ttp -66.01 -31.08 71.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.88 0.372 . . . . 10.0 110.922 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -64.27 -37.8 88.76 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.203 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -84.69 -28.37 26.42 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.188 0.518 . . . . 10.0 110.629 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . 0.648 HD21 ' HD3' ' D' ' 393' ' ' PRO . 13.8 tp -61.69 -32.1 72.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.746 -0.661 . . . . 10.0 112.022 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' D' ' 387' ' ' LYS . 19.8 ptmt -78.16 -12.06 59.97 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.905 0.706 . . . . 10.0 112.905 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . . . . . . . . . 8.7 t -98.61 -27.18 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 121.103 0.477 . . . . 10.0 109.775 179.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 389' ' ' ARG . 4.7 mmt85 -93.42 -32.15 14.34 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.423 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 72.34 50.48 16.17 Favored Glycine 0 C--N 1.329 0.184 0 C-N-CA 120.924 -0.655 . . . . 10.0 112.544 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 84.6 mt -115.28 -175.99 2.82 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.391 -0.226 . . . . 10.0 110.391 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -122.55 125.27 26.51 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 120.78 0.324 . . . . 10.0 110.74 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . 0.648 ' HD3' HD21 ' D' ' 386' ' ' LEU . 53.3 Cg_endo -68.35 -15.39 42.12 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.965 2.444 . . . . 10.0 112.528 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -68.22 -27.22 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.834 0.35 . . . . 10.0 111.838 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 97.4 m -98.89 2.9 47.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.052 0.453 . . . . 10.0 110.916 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . 0.497 ' HB3' HG12 ' D' ' 428' ' ' VAL . 23.4 m -113.8 153.29 29.35 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.948 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . 0.688 ' HB2' HD23 ' D' ' 431' ' ' LEU . . . -132.98 143.27 49.34 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.707 -0.479 . . . . 10.0 109.707 178.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 13.8 m -91.55 126.25 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.031 0.443 . . . . 10.0 111.753 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -125.48 145.06 50.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.823 -0.626 . . . . 10.0 109.402 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -102.26 175.18 5.61 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.106 -0.331 . . . . 10.0 110.106 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . 0.401 HD13 ' HB2' ' D' ' 425' ' ' GLU . 18.1 tp -58.7 148.23 30.09 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.345 0.403 . . . . 10.0 110.843 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.04 100.24 0.41 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -79.01 69.82 5.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.993 -0.548 . . . . 10.0 111.737 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 60.31 56.87 3.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.513 -0.767 . . . . 10.0 111.591 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -112.9 165.77 12.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.478 -0.783 . . . . 10.0 109.633 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -65.67 -30.76 71.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.904 0.383 . . . . 10.0 111.176 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.23 39.36 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.394 -0.908 . . . . 10.0 113.113 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -125.56 141.42 52.04 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.683 0.278 . . . . 10.0 110.365 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -72.63 138.65 46.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 10.0 109.684 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -95.65 107.55 19.76 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' D' ' 411' ' ' ARG . 35.9 ttp180 -68.74 125.72 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.053 0.454 . . . . 10.0 111.702 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.461 HD23 ' HA ' ' D' ' 412' ' ' LEU . 8.4 mt -102.75 -173.21 2.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.59 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -96.29 153.87 17.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.566 -0.743 . . . . 10.0 109.655 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -76.44 -22.83 54.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.833 0.349 . . . . 10.0 111.368 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.65 12.26 28.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.28 -0.418 . . . . 10.0 112.013 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 6.2 m -67.05 139.03 57.6 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.814 0.34 . . . . 10.0 111.001 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.22 124.01 23.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.482 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.81 70.18 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.698 0.629 . . . . 10.0 112.698 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.15 -17.97 63.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 111.958 0.355 . . . . 10.0 111.958 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 14.9 m -79.82 -17.73 52.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.308 -0.406 . . . . 10.0 111.456 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 2.0 mp -104.65 32.48 4.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.149 0.5 . . . . 10.0 111.217 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . 0.477 HG13 ' H ' ' D' ' 357' ' ' THR . 7.8 tt -64.01 119.53 8.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.057 -0.519 . . . . 10.0 111.246 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 92.87 5.23 64.56 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.317 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -110.25 156.08 21.16 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.167 0.508 . . . . 10.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.401 ' HB2' HD13 ' D' ' 401' ' ' LEU . 36.5 mt-10 -95.91 120.18 35.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.856 -0.611 . . . . 10.0 110.124 179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' D' ' 361' ' ' PHE . 11.2 tp -99.5 150.09 22.56 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.06 -0.718 . . . . 10.0 109.06 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -137.93 132.07 31.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.04 0.448 . . . . 10.0 111.546 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' D' ' 396' ' ' CYS . 13.1 t -116.41 88.97 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.356 0.598 . . . . 10.0 109.526 178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -96.82 163.31 13.04 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.293 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -80.41 135.96 36.26 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.099 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' D' ' 397' ' ' ALA . 1.0 OUTLIER -86.88 -36.78 18.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.664 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -152.7 100.52 2.55 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 179.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -168.96 173.4 6.99 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 53.6 t -81.21 117.59 68.78 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 109.625 -0.509 . . . . 10.0 109.625 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -86.6 175.96 5.01 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.587 2.192 . . . . 10.0 112.953 -178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 1.8 mm? 67.04 -173.36 0.19 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.639 -0.71 . . . . 10.0 112.582 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 5.0 m -104.59 135.27 46.31 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.813 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.38 143.0 28.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.537 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -65.38 123.49 19.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.378 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' D' ' 465' ' ' CYS . 21.4 t-20 -89.7 130.5 35.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.553 -0.749 . . . . 10.0 110.569 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.04 112.94 24.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.784 0.326 . . . . 10.0 111.099 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -142.99 128.92 19.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.156 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -104.8 117.12 33.27 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 10.0 110.252 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . 0.578 ' HG2' ' HD3' ' D' ' 464' ' ' ARG . 1.1 tttp -159.38 151.45 20.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.474 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' D' ' 444' ' ' LYS . 0.2 OUTLIER -64.42 156.55 29.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.281 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . 0.621 ' O ' ' H1 ' ' D' ' 514' ' ' 17F . 45.6 m-85 -102.16 162.54 12.84 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.546 -0.538 . . . . 10.0 109.546 178.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . 0.934 HD23 ' H1A' ' D' ' 514' ' ' 17F . 36.5 mt -72.5 -85.15 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.706 0.288 . . . . 10.0 110.927 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -90.3 -179.6 5.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.359 -0.382 . . . . 10.0 110.272 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 22.2 tp -88.67 102.9 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.051 0.453 . . . . 10.0 111.209 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.2 174.98 6.63 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.85 -0.796 . . . . 10.0 108.85 179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -122.0 134.8 54.81 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 3.3 t -66.36 121.82 16.14 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.637 -0.875 . . . . 10.0 108.637 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -81.39 -8.4 59.73 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.418 0.628 . . . . 10.0 110.04 179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 39.3 mm -83.32 -55.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.421 -0.809 . . . . 10.0 109.199 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -105.91 -157.2 0.6 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.899 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -125.46 61.7 1.21 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.363 0.601 . . . . 10.0 109.633 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -149.85 147.0 27.43 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.463 -0.79 . . . . 10.0 109.885 -179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -60.82 147.85 41.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 10.0 110.588 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.27 104.42 14.29 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.279 0.561 . . . . 10.0 111.083 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.436 ' HG ' ' H ' ' D' ' 460' ' ' LEU . 0.8 OUTLIER -89.01 -159.33 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.382 -0.826 . . . . 10.0 110.078 178.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.417 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 1.8 p-10 -77.44 74.74 4.0 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.407 0.622 . . . . 10.0 111.512 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -101.79 -131.87 7.52 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.597 -0.729 . . . . 10.0 112.533 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . 0.572 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 71.4 m-85 -109.79 154.58 22.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.032 0.444 . . . . 10.0 111.237 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.578 ' HD3' ' HG2' ' D' ' 444' ' ' LYS . 10.6 ptm180 -157.74 118.21 3.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.587 -0.733 . . . . 10.0 110.416 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.448 ' HB3' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -71.34 158.32 36.54 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.601 0.593 . . . . 10.0 112.601 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? -92.21 -37.79 12.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.531 -0.758 . . . . 10.0 110.522 179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 1.2 p -82.55 -56.48 3.84 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.093 -0.503 . . . . 10.0 110.891 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -79.99 -56.41 4.27 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.854 -0.612 . . . . 10.0 110.703 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . 0.435 ' H ' ' HB2' ' D' ' 465' ' ' CYS . . . 81.81 50.14 5.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.911 -0.661 . . . . 10.0 112.695 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.44 151.52 23.92 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.026 0.441 . . . . 10.0 110.417 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.409 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 17.2 pttt -104.32 120.14 40.53 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 179.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.877 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 44.2 p90 -163.82 165.93 22.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.332 0.493 . . . . 10.0 112.332 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -98.49 -179.01 4.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.6 . . . . 10.0 109.908 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . 0.572 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 42.8 mt-10 -72.33 -11.17 60.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.24 0.543 . . . . 10.0 111.056 179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 22.0 m80 -102.64 -7.54 21.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.794 -0.639 . . . . 10.0 109.962 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.877 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 4.7 m -98.71 -25.9 14.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.422 -0.354 . . . . 10.0 111.121 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -50.19 -44.9 53.2 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.189 0.811 . . . . 10.0 113.189 -178.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.72 4.24 29.81 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.124 0.488 . . . . 10.0 110.819 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.519 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 44.2 tttm -94.6 -34.5 12.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.97 -0.559 . . . . 10.0 111.196 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.445 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 14.0 p -66.92 118.77 58.38 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 121.334 0.588 . . . . 10.0 111.23 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 14.6 Cg_exo -70.91 -38.97 4.68 Favored 'Trans proline' 0 C--N 1.34 0.121 0 C-N-CA 122.851 2.368 . . . . 10.0 111.8 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.24 105.59 17.67 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.894 -0.594 . . . . 10.0 110.465 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 6.1 tpp -72.3 -176.61 1.89 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.945 -0.57 . . . . 10.0 112.083 -179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' D' ' 468' ' ' CYS . 58.7 m -78.91 62.82 3.46 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.868 -0.605 . . . . 10.0 112.452 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 20.3 t -114.47 91.8 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.294 -0.632 . . . . 10.0 109.294 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -125.53 142.87 51.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.033 -0.531 . . . . 10.0 109.806 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 37.5 p90 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.521 -0.309 . . . . 10.0 111.481 -179.601 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.081 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 1.07 H221 H262 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.026 H372 H411 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 0.969 H351 H152 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.248 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 1.129 H462 H251 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.068 H431 H232 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.066 H341 ' H57' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.066 ' H57' H341 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.991 ' H32' H211 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.067 H272 H281 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 0.973 ' C3 ' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.09 H382 H151 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 1.017 ' C40' H441 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.093 H412 H231 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.021 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.03 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.959 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.025 H142 H381 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.064 ' H2 ' ' H41' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.07 H272 ' H77' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.118 H171 H342 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.114 ' H61' H281 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.043 H431 ' H34' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 0.989 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.825 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.088 ' O2P' ' H63' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.108 H212 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.118 H342 H171 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 1.054 H242 H483 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.089 H221 H251 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.056 ' H39' H142 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.049 H412 H362 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.061 H422 H261 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.088 ' H63' ' O2P' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.884 H141 ' O9 ' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.025 H421 ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.017 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.107 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.06 ' H31' ' H32' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.114 H281 ' H61' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.061 H261 H422 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.043 ' H34' H431 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.149 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 1.015 ' H67' ' H39' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 0.916 ' H51' ' H57' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.021 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.02 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 0.893 ' H51' H442 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.017 H211 H231 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.256 H362 ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.037 H252 H151 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.06 H121 H342 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.018 ' H52' H10A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.078 H372 ' H34' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.089 H251 H221 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.06 H342 H121 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 1.006 H122 H152 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.051 H261 H252 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.068 H232 H431 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.028 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.078 ' H34' H372 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.018 H10A ' H52' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.035 ' H29' ' H71' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.763 ' O1G' ' HB3' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.096 H332 ' H37' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.03 H262 H411 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.051 H252 H261 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.067 H281 H272 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.075 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.129 H251 H462 ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 0.95 H351 ' H8 ' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.081 ' H2 ' ' H62' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.036 ' H51' ' C1 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.029 H342 H283 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.048 ' H43' H221 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.096 ' H37' H332 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 0.95 ' H8 ' H351 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.07 ' H77' H272 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.093 H231 H412 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.017 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 121.072 0.463 . . . . 10.0 110.285 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 6.7 tmtm? -60.29 -46.41 89.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.213 -0.903 . . . . 10.0 111.416 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.662 HD21 H282 ' A' ' 415' ' ' PCW . 89.7 mt -70.04 -30.85 68.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 10.0 111.341 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 13.0 mt -72.17 -45.69 59.42 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.891 -0.595 . . . . 10.0 110.487 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.32 -42.63 87.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.749 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.45 HD22 ' HA ' ' A' ' 206' ' ' ASN . 7.4 m120 -63.23 -32.42 73.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.374 -0.376 . . . . 10.0 111.728 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 43.9 t90 -71.91 -34.92 69.49 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -61.57 -30.08 70.43 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.19 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.73 -27.57 62.13 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.619 0.723 . . . . 10.0 110.058 178.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.15 -43.2 37.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.645 . . . . 10.0 109.952 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.0 -42.02 98.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 116.401 -0.363 . . . . 10.0 111.352 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 1.4 p -63.29 -36.02 82.3 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.09 0.472 . . . . 10.0 109.953 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 54.8 m -70.04 -40.83 74.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.989 -0.551 . . . . 10.0 109.943 178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -41.15 96.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.878 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 60.6 m -60.73 -40.65 93.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.451 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -72.34 -36.5 68.83 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.218 -0.446 . . . . 10.0 110.159 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 32.1 mt -64.74 -44.72 89.22 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.09 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -66.72 -29.31 69.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.035 0.445 . . . . 10.0 110.621 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -69.65 -42.1 74.69 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.242 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . 0.418 HE22 ' CD ' ' C' ' 553' ' ' GLU . 7.2 tp-100 -74.66 -31.77 62.04 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.486 -0.779 . . . . 10.0 109.803 179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 221' ' ' LEU . 11.6 mt -58.45 -29.58 66.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.702 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.47 -69.77 1.17 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.383 -1.087 . . . . 10.0 110.383 178.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -56.14 -39.58 90.29 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.323 2.015 . . . . 10.0 110.921 177.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . 0.441 ' HB ' ' HA ' ' A' ' 221' ' ' LEU . 21.7 t -54.28 -52.16 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.761 -0.2 . . . . 10.0 111.537 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.0 p -66.97 -39.51 87.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.982 -0.287 . . . . 10.0 111.089 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -64.26 -43.69 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.688 0.28 . . . . 10.0 111.521 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.63 -41.99 71.48 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.887 0.375 . . . . 10.0 110.544 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -66.63 -42.08 87.32 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.463 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.497 ' HB2' ' O ' ' A' ' 225' ' ' THR . 1.2 m-90 -65.74 -35.49 80.89 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.582 -0.525 . . . . 10.0 109.582 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.61 -45.03 95.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.995 -0.743 . . . . 10.0 108.995 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -74.39 -28.4 61.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.799 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 229' ' ' TRP . 18.3 mt -69.34 -37.03 77.48 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -64.77 -33.88 77.02 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.009 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -72.16 -40.38 68.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.28 -41.25 98.32 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.694 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 4.8 p -77.96 -35.34 50.37 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.924 179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.532 ' HG2' HE21 ' A' ' 241' ' ' GLN . 42.2 tt0 -62.94 -45.59 91.77 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -58.69 -42.19 96.17 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 109.785 -1.326 . . . . 10.0 109.785 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -40.12 95.71 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 178.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.424 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 60.4 mtt180 -63.4 -40.29 96.83 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.938 0.399 . . . . 10.0 110.207 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . 0.532 HE21 ' HG2' ' A' ' 237' ' ' GLU . 77.4 mt-30 -71.88 -40.58 68.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.801 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -68.63 -22.13 64.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.895 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . . . . . . . . . 28.9 ttm -64.63 -24.9 67.74 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 11.7 m -81.15 3.74 22.51 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.533 -0.758 . . . . 10.0 109.793 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 249' ' ' GLU . 62.9 mttm -124.92 -59.33 1.43 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.73 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.585 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 0.6 OUTLIER -55.28 -61.13 2.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.816 -0.629 . . . . 10.0 111.22 -179.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.469 ' HA ' HG12 ' A' ' 250' ' ' VAL . 25.7 mt -77.82 -38.28 46.71 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.745 0.646 . . . . 10.0 112.745 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -65.02 -50.82 64.78 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.022 0.379 . . . . 10.0 112.022 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 245' ' ' LYS . 1.6 mt-10 -67.44 -36.65 81.63 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.051 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.723 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.5 p -68.78 -26.71 33.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.674 0 C-N-CA 120.519 -0.472 . . . . 10.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 247' ' ' LEU . 51.4 tttt -75.11 -36.18 61.67 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.425 -0.584 . . . . 10.0 109.425 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -77.64 -36.78 51.19 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.558 -0.746 . . . . 10.0 110.109 179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -80.11 -29.05 38.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.868 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.723 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.8 OUTLIER -60.19 -26.96 38.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.548 0.214 . . . . 10.0 111.148 -179.718 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.445 ' HB2' ' CD ' ' A' ' 256' ' ' PRO . 53.2 mt-30 -63.68 -63.8 3.58 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.401 -0.363 . . . . 10.0 110.753 179.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.445 ' CD ' ' HB2' ' A' ' 255' ' ' GLN . 26.4 Cg_endo -64.79 -30.66 58.78 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 121.429 1.419 . . . . 10.0 111.407 178.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.456 ' O ' ' HD2' ' A' ' 261' ' ' PHE . 4.5 m-30 -64.3 -55.66 19.86 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.912 0.387 . . . . 10.0 110.11 179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . 0.509 ' HG ' HG22 ' A' ' 254' ' ' VAL . 69.1 mt -64.52 -36.24 83.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.302 -0.408 . . . . 10.0 110.632 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.46 -40.53 95.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.309 179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -61.92 -53.63 53.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.085 0.469 . . . . 10.0 109.904 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 257' ' ' TYR . 52.8 m-85 -63.93 -41.06 97.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.512 -0.767 . . . . 10.0 111.298 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 266' ' ' GLN . 64.3 tt0 -64.68 -42.94 95.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.806 0.336 . . . . 10.0 110.166 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.481 ' HB2' ' HE3' ' A' ' 263' ' ' LYS . 13.9 ttmt -61.53 -44.96 96.1 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.654 -0.499 . . . . 10.0 109.654 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.683 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 73.8 mttt -68.21 -39.53 82.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.523 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 3.1 m95 -64.36 -35.3 80.43 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.128 178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 262' ' ' GLN . 43.3 mt-30 -63.83 -42.39 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.375 -0.972 . . . . 10.0 108.375 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.32 -41.55 85.1 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.732 -0.667 . . . . 10.0 109.301 178.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -58.16 -39.76 79.65 Favored 'General case' 0 N--CA 1.461 0.113 0 N-CA-C 109.261 -0.644 . . . . 10.0 109.261 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . 0.485 ' CE ' H252 ' B' ' 201' ' ' PCW . 6.3 mmt -70.87 -46.94 61.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.513 -0.767 . . . . 10.0 110.184 178.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -55.33 -53.42 56.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.642 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.65 -43.08 98.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.571 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.514 ' HD1' ' HA ' ' A' ' 272' ' ' TYR . 0.1 OUTLIER -64.05 -39.54 94.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.379 . . . . 10.0 111.119 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.536 ' HA ' HG12 ' A' ' 276' ' ' VAL . 88.8 mtt180 -72.4 -34.81 68.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.016 0.436 . . . . 10.0 110.843 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -65.66 -32.84 74.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.412 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.71 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.9 mptt -91.69 -36.73 13.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.91 -0.586 . . . . 10.0 111.862 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 273' ' ' ARG . 2.8 p -54.81 -34.21 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 112.963 0.727 . . . . 10.0 112.963 -178.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.422 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 40.4 mt-10 -63.4 -61.37 7.31 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 121.099 -0.24 . . . . 10.0 111.277 179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.43 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.2 Cg_endo -63.66 -32.95 68.32 Favored 'Trans proline' 0 C--N 1.356 0.945 0 C-N-CA 121.745 1.63 . . . . 10.0 111.988 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.71 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 18.8 mt -63.93 -45.57 88.66 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 280' ' ' ARG . 42.8 ttm180 -63.8 -35.86 82.0 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.855 -0.611 . . . . 10.0 109.551 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.29 77.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.449 -0.796 . . . . 10.0 109.572 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 52.3 mt-10 -59.86 -45.58 91.98 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.25 -39.05 91.58 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.299 -0.864 . . . . 10.0 110.74 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -68.75 -47.56 65.94 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.124 0.265 . . . . 10.0 110.826 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -60.43 -44.47 95.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.079 0.466 . . . . 10.0 109.842 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -69.17 -40.16 82.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.697 -0.683 . . . . 10.0 111.724 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -59.62 -42.72 93.31 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.477 0.138 . . . . 10.0 110.858 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 288' ' ' ARG . 51.8 mtt85 -60.95 -38.98 87.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.654 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -67.81 -46.36 72.13 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.882 -0.414 . . . . 10.0 109.882 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -62.29 -42.11 99.07 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.232 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . 0.423 HD23 HD12 ' A' ' 294' ' ' LEU . 79.1 mt -69.33 -38.09 78.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.907 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -45.05 95.22 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.837 -0.431 . . . . 10.0 109.837 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -31.18 72.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.701 -0.681 . . . . 10.0 109.742 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.423 HD12 HD23 ' A' ' 291' ' ' LEU . 26.0 mt -68.87 -48.46 63.36 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.849 -0.614 . . . . 10.0 109.522 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.03 -44.0 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.478 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.27 -16.01 61.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.753 -0.658 . . . . 10.0 111.509 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 29.6 mmtp -113.55 6.33 16.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.24 0.543 . . . . 10.0 110.731 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.66 -33.09 5.95 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.871 -0.604 . . . . 10.0 111.032 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.596 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.4 m -74.51 -66.22 0.49 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 111.669 0.248 . . . . 10.0 111.669 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 35.0 Cg_endo -65.75 -46.88 4.45 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 121.392 1.394 . . . . 10.0 111.58 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.558 HD13 ' HG2' ' C' ' 473' ' ' LYS . 34.2 mt -66.6 -26.01 66.89 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.75 0.31 . . . . 10.0 110.46 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -73.81 -46.77 22.38 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.886 -1.286 . . . . 10.0 109.886 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.11 -35.71 81.17 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 109.419 -0.586 . . . . 10.0 109.419 178.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -69.32 -41.39 76.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.314 -0.857 . . . . 10.0 109.146 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.2 tpt -64.41 -40.51 95.93 Favored 'General case' 0 C--O 1.224 -0.254 0 N-CA-C 109.822 -0.436 . . . . 10.0 109.822 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.577 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 75.0 mtt180 -66.15 -41.59 90.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.879 -0.601 . . . . 10.0 109.643 178.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -64.34 -44.56 91.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.332 0.587 . . . . 10.0 109.754 178.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' A' ' 308' ' ' ARG . 4.8 mmt180 -64.04 -36.39 83.83 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.348 -0.612 . . . . 10.0 109.348 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.8 92.19 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.941 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.577 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 42.2 mtt180 -58.8 -47.61 84.17 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.037 -0.727 . . . . 10.0 109.037 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.76 -34.62 75.88 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.654 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.586 ' CD2' H283 ' C' ' 602' ' ' PCW . 0.4 OUTLIER -63.8 -54.34 36.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.788 -0.642 . . . . 10.0 109.7 178.989 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.622 ' HA ' HD12 ' A' ' 316' ' ' LEU . 41.6 t -69.61 -33.19 55.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.583 . . . . 10.0 111.608 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -64.51 -42.05 96.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.174 0.511 . . . . 10.0 110.132 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -65.96 -37.14 85.23 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.407 -0.96 . . . . 10.0 108.407 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 313' ' ' VAL . 37.2 mt -62.09 -51.94 65.91 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 115.455 -0.793 . . . . 10.0 109.239 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 16.5 mtm105 -59.38 -44.86 92.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.109 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 56.9 m -62.06 -30.24 70.85 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.127 0.489 . . . . 10.0 111.083 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 36.3 m170 -86.39 -36.4 19.19 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.413 179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 316' ' ' LEU . 67.2 mt -67.68 -30.47 70.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.684 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -53.0 -61.53 4.68 Favored Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 123.363 0.414 . . . . 10.0 111.665 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.487 ' O ' ' HG3' ' A' ' 326' ' ' GLU . 29.2 Cg_endo -66.64 -32.68 37.82 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.769 1.646 . . . . 10.0 110.848 178.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' A' ' 327' ' ' LEU . 15.2 m-30 -59.75 -50.25 74.57 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.655 -0.248 . . . . 10.0 111.065 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 10.7 p -61.6 -32.94 73.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.931 0.395 . . . . 10.0 110.624 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.584 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 2.8 t0 -70.51 -40.84 73.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.758 -0.656 . . . . 10.0 109.522 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 322' ' ' PRO . 55.2 mt-10 -64.31 -40.86 96.76 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.268 -0.642 . . . . 10.0 109.268 178.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 323' ' ' TYR . 95.9 mt -59.39 -40.09 85.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.003 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.584 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 81.7 mtt180 -59.63 -43.15 93.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.025 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 49.9 mt-30 -67.91 -47.88 67.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.626 -0.715 . . . . 10.0 110.546 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 46.8 mtt180 -61.59 -45.45 94.05 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.973 -0.558 . . . . 10.0 111.065 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 56.2 mt -62.3 -43.91 97.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.121 -0.49 . . . . 10.0 109.913 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -59.95 -46.42 89.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.707 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.85 78.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 10.0 110.853 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -64.44 -40.38 95.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.712 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.38 -45.2 84.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 10.0 111.352 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -66.04 -35.05 79.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.379 -0.373 . . . . 10.0 110.687 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -64.19 -38.34 90.72 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.706 -0.85 . . . . 10.0 108.706 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.51 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 81.7 mt -76.39 -11.47 59.9 Favored 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.583 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -87.96 -53.82 4.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.686 -0.487 . . . . 10.0 109.686 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -70.92 -64.73 0.85 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.996 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -66.33 -41.9 88.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.841 0.353 . . . . 10.0 110.225 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.13 -43.82 97.96 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.769 -0.729 . . . . 10.0 111.422 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -62.62 -38.51 96.52 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 111.342 -0.703 . . . . 10.0 111.342 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.096 0.475 . . . . 10.0 109.719 178.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . . . . . . . . . 20.1 mtm180 -69.91 -35.72 74.82 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.784 -0.644 . . . . 10.0 109.544 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 342' ' ' GLY . 78.2 mt -65.18 -46.9 78.93 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.335 -0.617 . . . . 10.0 109.335 178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.56 -37.39 81.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.485 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 352' ' ' LYS . 2.2 mt-10 -68.29 -40.8 81.66 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.614 -0.721 . . . . 10.0 110.134 178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -40.67 93.88 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.215 -0.448 . . . . 10.0 109.853 178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 65.6 m-70 -65.63 -41.06 93.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 10.0 109.764 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.47 91.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.156 -0.474 . . . . 10.0 109.823 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 348' ' ' GLU . 40.3 mttm -62.33 -44.39 96.59 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.972 -0.558 . . . . 10.0 109.748 178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -62.02 -36.74 82.47 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.186 -0.461 . . . . 10.0 110.265 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 77.6 m -58.1 -50.72 72.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.833 178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -70.38 -30.91 67.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.043 -0.526 . . . . 10.0 111.327 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -64.85 -35.06 79.91 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.452 -0.573 . . . . 10.0 109.452 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 76.0 mt -73.55 -34.11 65.03 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.265 0.555 . . . . 10.0 109.943 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 15.8 m -63.27 -49.15 75.18 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.0 -0.546 . . . . 10.0 110.044 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.6 p -70.17 -28.0 64.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.894 -0.41 . . . . 10.0 109.894 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 33.1 tp -68.37 -33.73 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 32.5 m -64.97 -29.29 70.21 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.131 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -72.35 -17.25 61.85 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.785 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.612 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 92.6 mttt -99.43 -38.14 8.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.679 -0.691 . . . . 10.0 110.038 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -70.8 -30.57 67.06 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.943 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.805 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 51.6 mtmt -102.8 -75.02 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 113.487 0.921 . . . . 10.0 113.487 179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.805 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 39.8 Cg_exo -58.41 -50.75 8.86 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.197 1.931 . . . . 10.0 113.321 -178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -63.8 -50.03 70.58 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.308 0.484 . . . . 10.0 112.308 -179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 368' ' ' LEU . 13.0 mt -62.1 -39.35 92.2 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 121.149 -0.22 . . . . 10.0 111.394 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -60.91 -48.18 82.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.613 178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -60.28 -41.0 92.4 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.067 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -48.49 75.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.287 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 96.5 mtt180 -61.29 -40.68 95.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.15 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -65.4 -23.67 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.323 -0.398 . . . . 10.0 110.665 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -89.02 -33.39 9.69 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 110.659 -0.976 . . . . 10.0 110.659 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.9 -27.66 67.68 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.695 -0.252 . . . . 10.0 110.898 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 62.6 mt -56.79 -63.23 3.78 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.47 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.428 ' CD ' ' HB2' ' A' ' 376' ' ' LEU . 29.1 Cg_endo -63.68 -30.54 69.83 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 121.983 1.788 . . . . 10.0 111.331 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 382' ' ' PHE . 38.6 t -64.28 -46.18 94.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 109.51 -0.552 . . . . 10.0 109.51 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.95 -37.31 85.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.084 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 384' ' ' VAL . 21.4 mt-10 -58.94 -49.75 76.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.129 178.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 3.2 p -70.29 -36.7 74.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.536 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 378' ' ' VAL . 0.2 OUTLIER -60.82 -41.97 96.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.018 -0.537 . . . . 10.0 109.877 178.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -61.18 -38.6 87.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.898 -0.592 . . . . 10.0 109.728 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 380' ' ' GLU . 84.6 t -62.82 -47.62 92.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.053 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 1.6 p -67.05 -24.65 66.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 10.0 111.473 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.448 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 0.7 OUTLIER -81.55 -45.4 15.95 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.136 179.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 76.2 mt -61.04 -46.28 91.35 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.735 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.546 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 5.9 p -63.4 -41.57 98.75 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.437 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -63.61 -39.13 93.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.161 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 80.7 mt -60.39 -41.12 93.15 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.826 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 54.9 mt-10 -68.56 -38.13 80.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 10.0 109.883 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -58.73 -40.08 82.76 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.949 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -60.69 -54.27 47.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.002 -0.544 . . . . 10.0 110.88 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -29.89 70.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -72.72 -22.23 60.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.012 0.375 . . . . 10.0 112.012 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.704 ' HE2' ' HA ' ' C' ' 587' ' ' ALA . 13.1 mptt -109.13 -43.25 4.21 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.455 0.539 . . . . 10.0 112.455 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 68.3 mt -76.38 -15.57 59.92 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.838 0.351 . . . . 10.0 111.804 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 16.7 t30 . . . . . 0 C--N 1.322 -0.627 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.626 -179.611 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . 0.402 HD13 ' HA ' ' C' ' 399' ' ' LEU . 3.8 mm? . . . . . 0 C--O 1.234 0.265 0 CA-C-O 121.137 0.494 . . . . 10.0 110.632 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -101.03 14.18 32.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.602 -0.727 . . . . 10.0 110.063 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 58.3 mt -65.89 -57.73 7.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.292 -0.867 . . . . 10.0 111.732 -178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.73 -24.05 67.61 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.364 -0.38 . . . . 10.0 111.416 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' C' ' 406' ' ' ASP . 7.2 t70 -74.18 -38.23 63.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.253 0.549 . . . . 10.0 109.789 179.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -72.09 -38.38 69.38 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.038 -1.097 . . . . 10.0 108.038 178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.44 -26.54 67.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.18 -0.918 . . . . 10.0 110.468 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' C' ' 403' ' ' ASP . 7.4 t70 -60.33 -43.22 96.59 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 14.8 m -65.75 -36.83 84.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.488 179.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 14.1 t -65.27 -38.39 82.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 109.125 -0.694 . . . . 10.0 109.125 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 25.4 m -61.86 -43.57 98.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.644 -0.873 . . . . 10.0 108.644 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 15.9 m -65.51 -31.12 72.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.148 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 23.7 m -64.69 -41.74 95.81 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.671 -0.862 . . . . 10.0 108.671 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.69 -42.68 95.14 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.295 -0.632 . . . . 10.0 109.295 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.518 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 9.9 m -60.97 -43.07 99.32 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.906 -0.588 . . . . 10.0 109.763 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.467 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.8 mmtt -65.34 -36.07 82.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.887 -0.597 . . . . 10.0 110.342 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' C' ' 411' ' ' THR . 63.1 mt -64.07 -37.86 88.98 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.13 -0.693 . . . . 10.0 109.13 177.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.518 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 60.1 mtt180 -66.88 -39.13 87.41 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.362 178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -66.17 -20.31 66.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.066 179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -91.18 -51.15 5.45 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.696 -0.684 . . . . 10.0 109.684 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 80.7 mt -55.52 -38.43 69.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.745 -0.661 . . . . 10.0 112.28 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -53.4 -73.71 0.38 Allowed Glycine 0 CA--C 1.524 0.606 0 C-N-CA 121.362 -0.447 . . . . 10.0 113.169 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -63.55 -32.62 69.89 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.613 2.208 . . . . 10.0 112.164 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.45 ' HA ' ' HG2' ' C' ' 425' ' ' GLU . 10.0 t -64.34 -42.27 94.87 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 112.531 0.567 . . . . 10.0 112.531 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 5.1 p -63.58 -34.71 78.42 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.079 -0.648 . . . . 10.0 110.273 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -64.29 -50.4 68.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.282 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.45 ' HG2' ' HA ' ' C' ' 422' ' ' VAL . 10.9 pt-20 -71.78 -28.26 63.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.871 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.41 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 37.2 t80 -70.97 -45.03 64.78 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.362 -0.607 . . . . 10.0 109.362 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 37.8 m0 -64.86 -36.34 84.02 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 108.902 -0.777 . . . . 10.0 108.902 177.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -64.4 -39.69 94.34 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.551 -0.907 . . . . 10.0 108.551 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -64.29 -42.47 96.37 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.127 -1.064 . . . . 10.0 108.127 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 92.6 mt -61.37 -42.44 98.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.179 178.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 10.9 mm-40 -60.1 -47.46 85.79 Favored 'General case' 0 N--CA 1.462 0.147 0 O-C-N 123.346 0.404 . . . . 10.0 110.207 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -62.88 -43.4 98.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.632 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -64.22 -52.1 60.44 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.196 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 14.9 p -60.04 -55.17 37.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.6 -0.273 . . . . 10.0 111.559 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 8.0 mm-40 -62.47 -39.42 93.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.664 0.269 . . . . 10.0 110.69 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.09 -44.54 95.64 Favored Glycine 0 N--CA 1.452 -0.261 0 N-CA-C 111.233 -0.747 . . . . 10.0 111.233 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 66.8 mt -66.52 -37.43 85.0 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.638 ' HA ' ' HB2' ' C' ' 441' ' ' MET . 75.2 mtt180 -62.22 -31.33 71.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.188 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 98.3 mt-30 -62.63 -42.3 99.51 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.153 -0.684 . . . . 10.0 109.153 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -77.78 -37.93 47.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.593 -0.73 . . . . 10.0 109.392 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . 0.638 ' HB2' ' HA ' ' C' ' 438' ' ' ARG . 60.6 mmm -59.09 -49.75 76.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.766 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' C' ' 446' ' ' GLU . 1.8 p -53.6 -49.54 67.56 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.714 0.292 . . . . 10.0 110.966 179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -67.52 -45.53 75.48 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.081 -0.509 . . . . 10.0 111.406 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -61.88 -38.84 89.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.394 -0.366 . . . . 10.0 111.667 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.442 ' O ' HG12 ' C' ' 448' ' ' VAL . 69.4 mt -67.7 -49.85 60.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.885 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' C' ' 442' ' ' SER . 25.6 mm-40 -63.61 -38.54 91.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -70.57 -41.8 71.95 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.617 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.442 HG12 ' O ' ' C' ' 445' ' ' LEU . 2.0 p -65.65 -32.66 59.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.552 -0.294 . . . . 10.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 93.0 mttt -62.87 -40.87 98.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.51 -0.922 . . . . 10.0 108.51 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -82.06 8.04 11.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.319 -0.855 . . . . 10.0 110.483 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 42.5 mttm -116.15 -44.66 2.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.364 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.416 HG23 HG22 ' C' ' 448' ' ' VAL . 76.4 t -59.69 -44.95 94.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.168 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.751 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 61.4 mt-30 -58.97 -58.12 21.89 Favored Pre-proline 0 CA--C 1.535 0.384 0 N-CA-C 111.783 0.29 . . . . 10.0 111.783 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.751 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 35.0 Cg_exo -60.34 -35.15 92.43 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.304 2.003 . . . . 10.0 111.698 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.523 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 1.4 t80 -66.96 -44.74 79.75 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.842 0.353 . . . . 10.0 110.222 179.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 31.4 mt -66.42 -35.96 81.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.592 -0.522 . . . . 10.0 109.592 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.72 -45.86 77.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.819 178.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -61.96 -41.87 98.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.815 -0.629 . . . . 10.0 109.482 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -68.51 -39.62 81.17 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.604 -0.725 . . . . 10.0 110.592 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' C' ' 460' ' ' GLN . 9.3 mm-40 -63.75 -36.85 85.23 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 25.4 mttt -67.31 -36.98 82.6 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.077 -0.712 . . . . 10.0 109.077 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.5 -44.16 65.18 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 10.0 110.097 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 41.3 m0 -65.45 -36.21 83.23 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 109.624 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -61.98 -51.42 68.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.578 -0.897 . . . . 10.0 108.578 178.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 3.2 mt-10 -57.64 -50.26 73.75 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.226 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.1 -47.55 82.9 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 54.8 mtm -60.84 -41.93 96.77 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.56 0.219 . . . . 10.0 110.903 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -65.05 -40.64 95.05 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.575 -0.528 . . . . 10.0 109.575 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 80.4 mt -63.06 -38.27 90.54 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -67.1 -33.53 75.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.198 0.523 . . . . 10.0 110.041 178.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -76.49 -22.96 53.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.271 -0.422 . . . . 10.0 111.13 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -102.48 -0.48 32.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.021 0.439 . . . . 10.0 111.448 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.558 ' HG2' HD13 ' A' ' 301' ' ' LEU . 95.7 mttt -128.27 -67.14 0.82 Allowed 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.292 -0.413 . . . . 10.0 111.059 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.43 -43.86 73.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 10.0 111.764 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -58.56 -61.28 7.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.67 -32.53 68.61 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.812 1.675 . . . . 10.0 111.762 178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 14.4 mt -64.73 -34.97 79.57 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -62.92 -32.15 73.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.304 -0.628 . . . . 10.0 109.304 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.59 -43.4 80.63 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.026 -0.731 . . . . 10.0 109.026 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.21 -39.15 82.49 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.971 -0.559 . . . . 10.0 109.738 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 20.1 mt -62.74 -43.18 99.47 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.886 -0.597 . . . . 10.0 109.406 178.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.63 -40.57 76.46 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.309 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' C' ' 486' ' ' ARG . 3.6 tp10 -62.14 -48.39 80.35 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.88 -0.785 . . . . 10.0 108.88 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.24 -33.57 87.61 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.347 -1.101 . . . . 10.0 110.347 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.43 -39.46 81.54 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.315 -0.624 . . . . 10.0 109.315 178.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' C' ' 483' ' ' GLU . 67.2 mtt180 -63.42 -39.13 93.65 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 108.766 -0.827 . . . . 10.0 108.766 178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -68.28 -44.64 75.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.672 -0.695 . . . . 10.0 109.245 178.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . 0.433 ' HA ' ' OE1' ' C' ' 491' ' ' GLU . 87.7 tttt -63.35 -44.19 95.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.423 179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.62 -30.54 71.27 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.605 -0.517 . . . . 10.0 109.605 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.65 -42.65 64.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 108.237 -1.023 . . . . 10.0 108.237 178.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' C' ' 488' ' ' LYS . 70.7 mt-10 -58.84 -49.03 79.27 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.655 -1.239 . . . . 10.0 107.655 177.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 58.4 mt -62.76 -36.26 82.48 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-N 114.99 -1.005 . . . . 10.0 111.164 179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -61.24 -44.88 96.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.018 0.437 . . . . 10.0 109.984 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.93 21.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.137 179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.697 ' HE3' HD22 ' A' ' 279' ' ' LEU . 15.1 mttp -137.61 -44.58 0.54 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.997 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.463 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 74.5 mt -66.4 -39.45 89.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.075 -0.511 . . . . 10.0 110.884 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.478 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 4.6 m -73.01 -64.3 0.89 Allowed Pre-proline 0 CA--C 1.539 0.545 0 N-CA-C 112.553 0.575 . . . . 10.0 112.553 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 28.3 Cg_endo -62.99 -55.53 0.77 Allowed 'Trans proline' 0 C--N 1.358 1.053 0 C-N-CA 122.177 1.918 . . . . 10.0 113.26 -179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' C' ' 495' ' ' LYS . 95.0 mt -68.24 -26.42 65.68 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.672 0.272 . . . . 10.0 110.864 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -64.61 -47.5 83.0 Favored Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.262 -1.135 . . . . 10.0 110.262 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -66.48 -35.7 80.92 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.462 -0.57 . . . . 10.0 109.462 178.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 12.2 tt0 -64.8 -44.77 88.84 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.705 -0.68 . . . . 10.0 109.585 178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.419 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 64.2 mmm -62.95 -37.53 87.44 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.6 -43.18 97.67 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.763 -0.828 . . . . 10.0 108.763 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.684 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 1.0 OUTLIER -62.04 -42.55 99.29 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.031 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 59.0 mtt180 -59.38 -47.95 83.5 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.635 -0.876 . . . . 10.0 108.635 178.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.65 -37.6 84.64 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.394 -0.821 . . . . 10.0 110.564 179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.684 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 90.4 mtt180 -59.28 -46.84 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.131 -0.692 . . . . 10.0 109.131 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.683 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -65.18 -36.94 85.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.459 -0.791 . . . . 10.0 110.784 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.634 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 40.6 m-70 -65.81 -51.49 58.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.114 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.426 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 96.2 t -65.61 -41.7 91.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.951 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.856 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 20.5 t70 -60.1 -39.57 86.63 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.154 0.502 . . . . 10.0 110.004 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . 0.477 ' HB2' ' NZ ' ' A' ' 264' ' ' LYS . . . -65.26 -46.92 78.55 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.12 -0.696 . . . . 10.0 109.12 178.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 80.9 mt -57.11 -29.04 63.2 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.016 -0.538 . . . . 10.0 111.22 179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.856 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 92.9 mtt180 -64.57 -31.24 72.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.168 -0.469 . . . . 10.0 110.659 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.08 5.39 18.61 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.982 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.419 ' HB2' ' HA ' ' C' ' 514' ' ' LEU . 18.1 m170 -113.39 -57.15 2.32 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.903 -0.589 . . . . 10.0 110.738 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 39.5 mt -80.44 -49.36 11.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.025 -0.534 . . . . 10.0 111.818 -178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.647 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -53.1 -57.07 17.94 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.841 0.682 . . . . 10.0 112.841 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 47.5 Cg_exo -60.34 -38.35 75.61 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.943 1.762 . . . . 10.0 110.918 179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.453 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 18.2 t80 -63.9 -33.88 76.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.299 -0.409 . . . . 10.0 109.96 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.483 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 21.6 m -66.83 -35.81 80.89 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.719 -0.474 . . . . 10.0 109.719 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.447 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 31.0 t70 -70.28 -38.5 75.05 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.448 -0.575 . . . . 10.0 109.448 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' C' ' 520' ' ' PRO . 46.8 mt-10 -66.37 -34.22 77.47 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 108.135 -1.061 . . . . 10.0 108.135 177.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 29.8 mt -69.94 -28.38 65.53 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.151 -0.932 . . . . 10.0 109.864 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' C' ' 522' ' ' SER . 74.1 mtt180 -62.02 -39.55 92.66 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.408 -0.59 . . . . 10.0 109.408 178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -69.76 -44.69 69.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.345 -0.843 . . . . 10.0 109.342 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.585 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 82.5 mtt180 -63.16 -42.57 99.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.384 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 61.5 mt -68.2 -32.58 72.91 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -64.08 -45.89 86.73 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.454 -0.572 . . . . 10.0 109.454 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.37 87.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.275 0.56 . . . . 10.0 109.493 178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -63.04 -41.51 99.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.551 -0.749 . . . . 10.0 109.705 178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.549 HD23 HD12 ' C' ' 536' ' ' LEU . 40.9 mt -71.22 -31.94 68.19 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.701 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.436 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 34.6 tt0 -63.75 -42.97 97.74 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.151 -1.055 . . . . 10.0 108.151 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -65.14 -33.5 76.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.681 -0.69 . . . . 10.0 109.191 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.549 HD12 HD23 ' C' ' 533' ' ' LEU . 51.4 mt -69.93 -26.28 64.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 10.0 110.373 179.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 43.0 mtmt -87.61 -34.15 18.61 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.299 178.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -70.18 -56.27 7.24 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.09 -0.707 . . . . 10.0 109.09 178.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.98 -37.12 72.74 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.473 -0.566 . . . . 10.0 109.473 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.443 ' O ' ' HB2' ' C' ' 544' ' ' LEU . . . -63.94 -42.9 98.14 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.625 -0.716 . . . . 10.0 111.734 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -65.49 -40.56 96.27 Favored Glycine 0 N--CA 1.449 -0.45 0 N-CA-C 110.779 -0.928 . . . . 10.0 110.779 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.07 61.75 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.954 0.407 . . . . 10.0 109.956 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.601 ' HA ' ' HB2' ' C' ' 546' ' ' GLU . 51.3 mtt85 -63.19 -25.14 68.2 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 116.066 -0.515 . . . . 10.0 110.801 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' C' ' 540' ' ' GLY . 1.4 tt -65.46 -50.1 66.62 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.33 87.3 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.521 -0.763 . . . . 10.0 109.669 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' C' ' 543' ' ' ARG . 13.5 mt-10 -60.26 -49.25 78.35 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.953 178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -60.23 -42.79 95.99 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.256 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -64.89 -49.42 70.54 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.307 0.379 . . . . 10.0 111.072 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -60.2 -49.42 77.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.836 0.351 . . . . 10.0 110.472 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.55 -33.25 75.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.404 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -69.43 -38.51 77.9 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.556 -0.535 . . . . 10.0 109.556 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 23.8 m -62.77 -45.59 91.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.418 ' CD ' HE22 ' A' ' 220' ' ' GLN . 36.5 mt-10 -62.26 -46.8 87.18 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.508 -0.553 . . . . 10.0 109.508 178.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -59.58 -46.16 89.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.78 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 25.8 tp -60.22 -37.96 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.262 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 20.2 m -67.53 -45.08 76.74 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.417 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -25.49 64.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.993 0.425 . . . . 10.0 110.499 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' C' ' 558' ' ' LEU . 17.5 mt -64.34 -54.38 33.91 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.949 178.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . 0.474 ' HA ' ' HB3' ' C' ' 562' ' ' ALA . 0.1 OUTLIER -69.35 -29.74 67.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 10.0 110.435 179.677 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.45 -35.44 72.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.542 -0.754 . . . . 10.0 109.708 178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.34 -36.03 11.01 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.717 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' C' ' 559' ' ' SER . . . -53.22 -47.33 69.05 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.781 0.66 . . . . 10.0 112.781 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -58.5 -61.93 6.64 Favored Pre-proline 0 CA--C 1.533 0.304 0 N-CA-C 112.828 0.677 . . . . 10.0 112.828 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.465 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 23.5 Cg_endo -62.73 -39.22 44.35 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.664 1.576 . . . . 10.0 112.959 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -65.78 -50.23 65.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.666 -0.243 . . . . 10.0 111.455 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 27.7 mt -64.02 -43.18 96.39 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 121.004 -0.278 . . . . 10.0 111.084 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -64.5 -39.03 93.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 10.0 110.669 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 2.1 t70 -68.75 -40.46 79.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 179.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.05 -42.96 99.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.049 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -65.87 -49.25 68.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.345 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -64.03 -22.3 66.87 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.942 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -89.85 -37.91 6.69 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.373 -0.691 . . . . 10.0 111.373 179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 15.5 mt -60.57 -35.75 76.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 122.118 0.167 . . . . 10.0 111.413 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' C' ' 575' ' ' PRO . 71.3 mt -53.76 -64.06 2.09 Favored Pre-proline 0 CA--C 1.533 0.306 0 N-CA-C 112.013 0.375 . . . . 10.0 112.013 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' C' ' 574' ' ' LEU . 38.4 Cg_endo -67.77 -33.66 26.72 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.798 1.665 . . . . 10.0 111.992 179.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 5.3 t -60.77 -49.66 83.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 109.87 -0.419 . . . . 10.0 109.87 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' C' ' 577' ' ' LEU . 28.8 mt -65.68 -37.9 87.79 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.893 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 47.6 mm-40 -61.83 -45.04 95.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.946 0.403 . . . . 10.0 110.11 178.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 13.0 m -63.89 -39.32 93.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.219 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . 0.402 ' HD1' ' HA ' ' C' ' 580' ' ' PHE . 4.3 m-30 -66.49 -40.33 89.23 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.041 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -57.22 -51.32 69.81 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.2 179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 59.8 t -58.16 -38.81 70.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 120.949 0.404 . . . . 10.0 110.556 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 19.7 m -69.24 -43.42 74.04 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.359 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -67.47 -42.96 82.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.166 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 55.9 mt -58.18 -49.38 77.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.312 -0.404 . . . . 10.0 111.013 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 4.9 p -67.97 -33.94 75.6 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.156 -0.474 . . . . 10.0 110.429 179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.704 ' HA ' ' HE2' ' A' ' 396' ' ' LYS . . . -62.58 -50.41 71.42 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.337 -0.392 . . . . 10.0 110.149 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 61.4 mt -58.15 -43.2 87.22 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.696 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -58.8 -49.68 76.77 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 10.0 110.572 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.07 -46.07 92.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.942 -0.572 . . . . 10.0 111.282 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.599 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 22.2 m-30 -62.48 -34.65 77.27 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.253 -0.431 . . . . 10.0 111.403 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 10.3 m -74.72 -19.56 60.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.103 0.478 . . . . 10.0 110.602 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -85.99 -39.81 16.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.398 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.546 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 9.8 mptt -71.61 -35.41 70.47 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.23 0.538 . . . . 10.0 110.588 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.6 60.11 0.62 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.378 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.806 -0.634 . . . . 10.0 111.53 -179.08 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.4 ptm . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.849 0.357 . . . . 10.0 111.234 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.13 115.94 22.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.262 -0.427 . . . . 10.0 111.051 -179.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.521 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 22.2 tt0 -81.68 143.08 32.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.569 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -131.99 121.7 24.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.307 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -82.78 106.38 14.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.706 0.288 . . . . 10.0 110.254 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 51.8 mt -112.92 115.6 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.926 0.393 . . . . 10.0 111.686 -179.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 41.5 t -117.79 113.77 43.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.515 HG12 ' HB2' ' B' ' 79' ' ' LEU . 16.8 m -91.06 156.78 2.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.771 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.423 HG21 HD11 ' B' ' 100' ' ' ILE . 2.1 m -142.64 159.49 18.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.217 -0.661 . . . . 10.0 109.217 179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 170.81 176.62 40.22 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.617 -0.801 . . . . 10.0 112.417 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.06 169.4 14.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.233 -0.284 . . . . 10.0 110.233 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . 0.456 ' HA3' ' HG3' ' B' ' 61' ' ' GLN . . . -84.77 117.89 4.61 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.444 -0.884 . . . . 10.0 112.506 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 113.57 4.55 23.21 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.831 -0.7 . . . . 10.0 112.652 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.08 -7.85 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.867 0.365 . . . . 10.0 111.551 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.54 ' HA3' ' C8 ' ' B' ' 216' ' ' GNP . . . 79.19 42.12 12.64 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.557 -1.017 . . . . 10.0 110.557 -179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.4 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.4 ttpp -69.33 -39.66 78.06 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.359 -0.421 . . . . 10.0 111.381 -179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . 0.425 ' OG ' ' O2G' ' B' ' 216' ' ' GNP . 26.6 m -74.72 -30.53 61.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.078 0.466 . . . . 10.0 111.182 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.74 -39.8 85.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.555 . . . . 10.0 110.335 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 60.6 mt -64.07 -37.57 87.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.84 -0.618 . . . . 10.0 111.924 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.429 HG22 ' HD1' ' B' ' 40' ' ' TYR . 0.0 OUTLIER -69.61 -55.44 10.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.847 0.356 . . . . 10.0 111.597 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.805 HD13 HG13 ' D' ' 388' ' ' VAL . 22.1 mt -62.8 -37.01 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.194 0.442 . . . . 10.0 112.194 -178.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.593 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 31.4 tp60 -75.43 -12.01 60.16 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.978 0.418 . . . . 10.0 111.76 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 30.4 tp -99.0 -47.49 5.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.864 0.364 . . . . 10.0 111.916 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -82.46 -54.44 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.388 -0.369 . . . . 10.0 111.776 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -85.1 -16.71 39.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.839 0.352 . . . . 10.0 110.803 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 39.2 m-20 63.16 34.01 13.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.447 -0.797 . . . . 10.0 111.251 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -126.09 150.22 48.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.064 -0.516 . . . . 10.0 110.679 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -111.4 156.63 21.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.969 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 16.7 m -116.12 179.43 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.3 179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -135.8 -28.33 1.09 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.028 0.442 . . . . 10.0 110.251 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -82.31 170.51 15.28 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.898 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.523 ' HD1' H5'2 ' B' ' 216' ' ' GNP . 86.3 t80 -128.14 103.89 7.46 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.848 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -123.23 121.77 26.96 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 115.84 -0.618 . . . . 10.0 109.514 178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.68 127.89 28.04 Favored 'Trans proline' 0 C--O 1.238 0.493 0 C-N-CA 122.749 2.299 . . . . 10.0 112.271 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.464 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 27.5 m -97.14 142.63 28.83 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.985 -0.552 . . . . 10.0 110.684 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.661 HD11 ' HB2' ' D' ' 371' ' ' ASN . 18.2 mt -114.98 -47.98 4.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.06 0.457 . . . . 10.0 110.377 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.652 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 30.3 tt0 -156.46 119.63 4.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.746 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -148.36 123.43 10.1 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -105.54 151.96 23.65 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.958 -0.297 . . . . 10.0 110.992 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' B' ' 20' ' ' THR . 0.4 OUTLIER -129.34 150.88 50.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.487 -0.324 . . . . 10.0 110.825 179.166 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.31 123.7 10.31 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -146.04 135.79 23.34 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 110.534 -0.173 . . . . 10.0 110.534 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -74.71 93.85 2.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.397 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 29.1 m -113.7 153.66 15.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.953 0.406 . . . . 10.0 111.932 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 21.6 t -112.62 118.3 57.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 108.836 -0.801 . . . . 10.0 108.836 179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.416 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 53.5 mt -120.57 117.63 53.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.89 0.376 . . . . 10.0 110.987 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.74 33.59 17.83 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.672 -0.695 . . . . 10.0 112.128 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.44 -4.64 85.93 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.113 -0.565 . . . . 10.0 114.055 179.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -118.28 128.23 54.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.198 0.499 . . . . 10.0 110.638 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.77 123.53 18.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.925 -0.58 . . . . 10.0 109.707 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . 0.416 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 55.2 m -118.07 155.43 30.37 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.084 0.469 . . . . 10.0 111.495 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.521 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 20.4 tp -122.32 94.69 4.37 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 10.0 108.864 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 mt -78.99 98.64 6.52 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.149 -0.478 . . . . 10.0 111.299 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -81.72 76.65 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.989 -0.745 . . . . 10.0 108.989 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 15.7 mt -81.49 124.51 39.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.211 -0.904 . . . . 10.0 111.572 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.644 HD11 ' HG3' ' B' ' 37' ' ' GLU . 55.6 tp -117.47 118.26 31.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.031 -0.531 . . . . 10.0 110.079 179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.4 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 32.8 t0 -84.9 119.34 25.24 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.493 -0.558 . . . . 10.0 109.493 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 37.3 p -90.08 -172.9 3.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.055 0.455 . . . . 10.0 111.472 -178.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' B' ' 35' ' ' THR . . . -94.68 136.04 35.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.216 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -85.7 -46.7 5.36 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 111.491 -0.644 . . . . 10.0 111.491 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' HA3' ' B' ' 12' ' ' GLY . 96.6 mt-30 -91.09 50.81 1.83 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.231 0.538 . . . . 10.0 110.509 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -118.28 147.31 43.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.894 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -94.55 -152.9 0.36 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.068 -0.515 . . . . 10.0 109.646 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -87.75 110.52 20.52 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.917 0.389 . . . . 10.0 111.451 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -120.34 148.91 43.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.888 -0.597 . . . . 10.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.48 -31.49 70.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.531 -0.304 . . . . 10.0 111.317 -179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 65.4 mmm -62.54 -37.75 87.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.002 0.429 . . . . 10.0 110.869 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 18.3 ttm-85 -58.17 -45.56 87.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.808 -0.633 . . . . 10.0 110.698 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -19.52 62.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.607 -0.724 . . . . 10.0 111.277 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -80.48 -59.78 2.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.26 0.467 . . . . 10.0 112.26 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.558 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 13.7 p90 -75.48 -26.92 58.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 114.308 1.225 . . . . 10.0 114.308 -178.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' B' ' 68' ' ' ARG . 2.3 ttp -76.16 -20.82 57.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.031 -0.267 . . . . 10.0 111.591 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 33.5 ttm180 -75.36 -26.27 58.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.045 0.45 . . . . 10.0 111.31 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.4 m -86.55 2.44 48.08 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.449 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -78.68 145.18 28.62 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.681 -0.771 . . . . 10.0 111.605 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -106.99 -44.31 4.43 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.928 0.394 . . . . 10.0 110.368 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.71 138.26 14.85 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.311 -0.716 . . . . 10.0 111.311 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.554 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 16.9 m-85 -127.42 116.14 19.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.072 0.463 . . . . 10.0 112.141 -178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.825 ' HG ' HD22 ' B' ' 159' ' ' LEU . 32.7 mt -102.01 112.79 25.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.846 -0.616 . . . . 10.0 109.606 178.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.405 ' HB2' HD12 ' B' ' 113' ' ' LEU . 12.7 m -85.73 92.83 8.71 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.267 -0.424 . . . . 10.0 110.359 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.8 m -90.18 144.58 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.937 -0.574 . . . . 10.0 111.173 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.749 ' HB3' HD11 ' B' ' 93' ' ' ILE . 27.7 p90 -158.4 161.97 37.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.212 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.542 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -93.77 119.83 33.24 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.589 -0.523 . . . . 10.0 109.589 179.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.975 HD11 ' HA ' ' B' ' 118' ' ' CYS . 48.3 pt -76.0 -6.78 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 121.118 0.485 . . . . 10.0 111.675 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.542 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 3.1 p-10 -83.29 -9.42 59.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.69 -0.687 . . . . 10.0 110.083 179.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -128.39 131.51 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.327 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -41.04 77.81 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.548 0.573 . . . . 10.0 112.548 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 54.7 tttp -56.22 -39.37 72.37 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.865 0.691 . . . . 10.0 112.865 -178.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -59.61 -38.83 82.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.821 0.343 . . . . 10.0 111.757 -179.678 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -69.2 -33.53 73.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.423 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -84.14 -19.5 34.07 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.329 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.96 -13.84 59.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.94 0.4 . . . . 10.0 110.7 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.749 HD11 ' HB3' ' B' ' 82' ' ' PHE . 40.8 mm -60.09 -40.04 82.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.836 -0.62 . . . . 10.0 111.103 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -54.33 -44.78 72.38 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.411 -0.359 . . . . 10.0 111.364 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.56 -53.62 55.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.965 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -63.62 -40.7 97.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.251 0.463 . . . . 10.0 112.251 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -60.31 -46.79 88.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.921 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -74.89 -24.9 58.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.134 -0.485 . . . . 10.0 111.004 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.515 ' O ' HG23 ' B' ' 103' ' ' VAL . 36.6 tt0 -66.95 -48.32 68.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.423 HD11 HG21 ' B' ' 9' ' ' VAL . 95.7 mt -59.49 -42.61 88.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.006 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' B' ' 107' ' ' GLU . 46.7 mtpt -54.98 -41.53 71.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.044 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 36.0 ttp85 -72.06 -41.68 67.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.906 0.384 . . . . 10.0 111.254 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.515 HG23 ' O ' ' B' ' 99' ' ' GLN . 39.5 t -64.14 -46.23 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.325 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -80.18 -12.73 59.62 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.267 -0.424 . . . . 10.0 111.635 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 33.7 t70 60.05 48.83 8.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.647 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 66.4 m -158.77 140.0 13.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.724 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . 0.468 ' HA ' ' HE3' ' B' ' 101' ' ' LYS . 13.6 mt-10 -80.63 -46.34 15.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.402 0.62 . . . . 10.0 109.382 179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -95.24 101.56 13.31 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.093 -0.958 . . . . 10.0 110.741 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -130.09 156.38 79.3 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 10.0 109.9 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.24 91.26 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.828 2.352 . . . . 10.0 112.413 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.554 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 59.2 mtm -123.32 141.02 52.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.63 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.683 ' HB ' HD23 ' B' ' 79' ' ' LEU . 86.6 t -132.11 135.58 58.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.558 -0.534 . . . . 10.0 109.558 179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 80' ' ' CYS . 14.0 tp -84.01 129.62 34.91 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.103 0.478 . . . . 10.0 110.508 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.592 ' HB ' HG12 ' B' ' 81' ' ' VAL . 16.2 t -125.4 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.473 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.68 113.43 4.71 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 111.005 -0.838 . . . . 10.0 111.005 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.431 ' HA ' ' O ' ' B' ' 144' ' ' THR . 66.6 t30 -95.84 161.55 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.894 0.347 . . . . 10.0 111.498 -178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.593 ' HG2' ' C6 ' ' B' ' 216' ' ' GNP . 87.3 mttt 62.47 45.42 6.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.619 -0.719 . . . . 10.0 112.018 179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.975 ' HA ' HD11 ' B' ' 84' ' ' ILE . 15.6 p -79.31 -13.61 59.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.733 -0.667 . . . . 10.0 112.259 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -90.47 4.02 52.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.165 0.507 . . . . 10.0 110.963 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' B' ' 117' ' ' LYS . 49.8 mt -88.88 133.18 36.16 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.225 -0.443 . . . . 10.0 110.3 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -65.08 -13.85 42.01 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.558 2.172 . . . . 10.0 112.244 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 1.8 m -81.83 18.62 1.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.616 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.517 ' HG3' HD12 ' B' ' 84' ' ' ILE . 27.2 ttm-85 -57.64 111.32 1.09 Allowed 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 120.905 0.384 . . . . 10.0 110.825 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 22.6 m -97.78 -37.59 9.8 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.201 -0.454 . . . . 10.0 110.382 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 39.7 t -91.96 129.86 41.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.693 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 18.6 t70 -90.01 149.57 22.49 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.048 -0.352 . . . . 10.0 110.048 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.654 ' HB ' ' H82' ' C' ' 602' ' ' PCW . 2.7 m -56.33 -38.35 71.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.748 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.663 ' HB2' ' H63' ' C' ' 602' ' ' PCW . 11.9 tttm -64.9 -36.99 86.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.51 -0.314 . . . . 10.0 111.483 -178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.693 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 26.5 mt-30 -65.26 -46.22 81.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-O 120.978 0.418 . . . . 10.0 110.087 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.5 -39.26 81.35 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.05 -0.523 . . . . 10.0 111.245 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.603 ' OE1' ' H51' ' C' ' 602' ' ' PCW . 70.1 mt-30 -61.38 -42.45 98.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.424 -0.353 . . . . 10.0 111.467 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -64.61 -44.94 88.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.146 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.15 -48.14 74.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.969 -0.56 . . . . 10.0 110.476 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.88 -41.52 87.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.561 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' B' ' 135' ' ' ARG . 12.1 tpt180 -65.03 -27.6 68.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.251 -0.431 . . . . 10.0 111.034 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 14.2 m -69.26 -33.91 73.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.98 0.419 . . . . 10.0 110.523 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -87.67 -26.28 23.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.215 0.531 . . . . 10.0 110.683 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 99.19 22.23 13.54 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.826 -0.702 . . . . 10.0 112.006 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 39.7 pt -114.22 150.91 44.45 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.411 0.106 . . . . 10.0 110.863 -179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -81.88 156.14 17.94 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 123.007 2.471 . . . . 10.0 112.291 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.43 ' HE2' HG23 ' B' ' 127' ' ' THR . 31.8 t80 -134.89 126.16 28.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 10.0 110.889 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 22.9 mm -130.93 136.63 57.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 10.0 110.951 179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -88.24 138.0 31.83 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.282 -0.417 . . . . 10.0 109.894 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.0 OUTLIER -142.84 158.69 43.38 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.168 -0.469 . . . . 10.0 111.313 -179.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 8.2 t -134.6 122.83 22.88 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.734 -0.666 . . . . 10.0 109.439 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 22' ' ' GLN . . . -69.88 -28.56 65.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.066 0.46 . . . . 10.0 110.151 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 19.0 tttm -73.05 -49.01 31.09 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.728 -0.669 . . . . 10.0 111.225 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 1.9 m -78.74 -27.67 44.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.048 -0.524 . . . . 10.0 112.313 -178.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.593 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 2.7 ttt-85 59.43 37.03 23.29 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.154 0.502 . . . . 10.0 111.885 179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -98.49 126.07 43.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.15 -0.477 . . . . 10.0 111.289 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 60.82 23.68 61.49 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 114.826 0.69 . . . . 10.0 114.826 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 18.1 t -78.45 -31.67 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-O 121.114 0.483 . . . . 10.0 111.434 -179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -66.37 -51.36 57.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.093 0.473 . . . . 10.0 110.313 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . 0.533 ' OD1' ' H52' ' B' ' 212' ' ' PCW . 1.1 t70 -68.0 -19.71 64.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.702 -0.681 . . . . 10.0 112.051 -179.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.2 96.32 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.071 -0.714 . . . . 10.0 109.071 178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -79.24 -36.46 39.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.431 -0.804 . . . . 10.0 110.144 178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.461 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 22.4 m-30 -59.83 -40.83 89.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.957 -0.565 . . . . 10.0 110.614 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 68.5 m -63.03 -39.42 94.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.591 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.825 HD22 ' HG ' ' B' ' 79' ' ' LEU . 25.3 tp -61.12 -43.71 98.46 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.198 -0.667 . . . . 10.0 109.198 178.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 89.2 t -63.02 -42.04 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.709 -0.678 . . . . 10.0 109.702 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.516 ' NH1' ' H51' ' B' ' 212' ' ' PCW . 61.7 mtt180 -61.9 -41.63 98.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.099 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -62.82 -36.17 82.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.085 -0.507 . . . . 10.0 111.459 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.436 HG13 ' O ' ' B' ' 159' ' ' LEU . 85.0 mt -65.38 -41.17 90.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 109.266 -0.642 . . . . 10.0 109.266 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -67.3 -38.45 85.02 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.49 -0.777 . . . . 10.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.462 ' HE2' ' O4P' ' B' ' 206' ' ' PCW . 84.1 mttt -70.13 -36.61 74.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.09 -0.505 . . . . 10.0 109.846 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -59.77 -42.59 93.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.209 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.8 mttm -63.82 -35.93 82.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.277 0.56 . . . . 10.0 110.154 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.808 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 18.7 tt0 -71.14 -39.83 71.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.124 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -61.9 -43.29 99.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.048 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 15.6 mmt -63.17 -27.14 69.16 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.174 -0.466 . . . . 10.0 111.716 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 15.8 m -84.88 -31.08 23.92 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.808 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 38.0 mtmt -95.32 -27.98 15.2 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.342 0.867 . . . . 10.0 113.342 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.19 -50.37 6.03 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.749 0.309 . . . . 10.0 110.655 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 70.6 -136.94 26.65 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.699 -0.682 . . . . 10.0 113.104 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -124.03 41.53 3.47 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.453 0.644 . . . . 10.0 109.699 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.415 ' HE3' ' HB2' ' B' ' 176' ' ' LYS . 23.0 mtmt -127.96 105.74 8.62 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.297 -0.865 . . . . 10.0 109.282 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.79 135.16 47.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.909 0.385 . . . . 10.0 111.459 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . 0.528 ' HE2' ' H63' ' B' ' 201' ' ' PCW . 4.7 pttm -135.22 -79.39 0.44 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.813 -0.63 . . . . 10.0 109.884 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 54.41 -163.55 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 O-C-N 123.454 0.471 . . . . 10.0 111.7 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . 0.685 ' HG2' H222 ' A' ' 403' ' ' PCW . 8.3 mptt -144.3 151.36 39.27 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.714 -0.847 . . . . 10.0 108.714 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 42.9 m -147.05 113.36 5.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.352 0.12 . . . . 10.0 110.998 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? 72.94 107.43 0.07 Allowed 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.78 0.675 . . . . 10.0 111.446 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . 0.643 HG21 H242 ' A' ' 403' ' ' PCW . 15.1 t -140.14 138.23 35.06 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.771 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . 19.4 ttpp -158.29 101.72 1.73 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.172 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.819 ' SG ' H481 ' C' ' 619' ' ' PCW . 40.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.985 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 54.1 t30 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.952 0.406 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.67 131.84 28.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.813 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 4.0 tp -101.43 128.62 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.107 0.48 . . . . 10.0 110.287 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.438 ' HB3' ' HB3' ' D' ' 425' ' ' GLU . 10.7 mtt180 -86.04 92.99 8.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 10.0 110.959 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 94.0 t -85.78 115.36 27.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.023 179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . 0.411 ' HB3' ' HG3' ' D' ' 427' ' ' GLN . 1.9 t80 -100.67 140.57 34.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.022 0.439 . . . . 10.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.813 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.4 mp -111.1 166.1 11.43 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.763 -0.653 . . . . 10.0 109.748 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.599 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 10.6 Cg_endo -53.05 160.12 4.66 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.944 2.43 . . . . 10.0 112.884 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 69.87 -87.43 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.287 -0.87 . . . . 10.0 112.051 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -158.27 27.53 0.25 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.961 0.41 . . . . 10.0 111.155 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.813 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.3 OUTLIER -92.42 152.24 19.81 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.62 -0.432 . . . . 10.0 111.908 -179.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' D' ' 367' ' ' ARG . 14.9 ptt85 -150.56 143.52 24.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.072 -0.513 . . . . 10.0 110.344 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.505 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 11.0 m -143.06 129.67 20.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.094 179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.652 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 32.9 t -101.93 109.67 26.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.585 -0.524 . . . . 10.0 109.585 179.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 5.1 m -103.17 152.96 5.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.988 0.423 . . . . 10.0 111.235 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.661 ' HB2' HD11 ' B' ' 36' ' ' ILE . 23.0 t-20 -106.79 112.73 25.84 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.787 -0.642 . . . . 10.0 110.085 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 19.3 m -86.57 165.11 2.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.993 0.425 . . . . 10.0 110.842 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' D' ' 373' ' ' ARG . 2.9 tpp85 -163.5 145.81 9.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.871 -0.418 . . . . 10.0 109.871 -179.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 69.59 -83.7 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.947 0.779 . . . . 10.0 111.235 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -159.23 101.21 0.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.337 -1.105 . . . . 10.0 110.337 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 55.4 mtt -125.52 129.65 50.17 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.155 0.502 . . . . 10.0 111.044 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 96.7 p -99.54 -178.82 4.01 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.703 -0.68 . . . . 10.0 109.269 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.488 HD12 ' HB ' ' D' ' 416' ' ' THR . 2.5 mt -59.46 -39.91 85.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.99 0.424 . . . . 10.0 110.261 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.05 -48.21 82.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.049 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -60.85 -38.16 84.58 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.988 0.423 . . . . 10.0 111.657 -179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 32.3 m -75.79 -42.53 49.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.098 -0.501 . . . . 10.0 112.068 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' D' ' 386' ' ' LEU . 42.3 mt -68.19 -32.13 72.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.689 0.255 . . . . 10.0 111.689 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 31.1 ttp -59.86 -20.96 60.15 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 123.651 0.595 . . . . 10.0 111.445 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -68.7 -67.66 0.45 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.896 0.379 . . . . 10.0 110.983 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -69.12 -16.73 63.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.587 0.232 . . . . 10.0 111.591 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' D' ' 382' ' ' LEU . 14.9 tp -57.86 -45.04 86.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.519 -0.309 . . . . 10.0 110.29 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -78.57 -23.38 46.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.38 -0.373 . . . . 10.0 110.908 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.805 HG13 HD13 ' B' ' 21' ' ' ILE . 57.1 t -73.47 -46.65 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.908 0.385 . . . . 10.0 110.399 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . 0.529 ' NH2' ' HG2' ' D' ' 366' ' ' GLN . 11.1 mmt180 -81.98 -34.32 29.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 111.302 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 76.45 59.76 3.21 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.128 -0.558 . . . . 10.0 112.553 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 86.5 mt -133.14 166.59 22.09 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 110.361 -0.237 . . . . 10.0 110.361 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -98.11 133.37 23.17 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 10.0 111.314 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.98 -9.19 22.01 Favored 'Trans proline' 0 N--CA 1.466 -0.133 0 C-N-CA 122.83 2.354 . . . . 10.0 112.592 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -68.22 -29.67 68.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.044 -0.526 . . . . 10.0 111.479 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . 0.462 ' HA ' ' CD2' ' D' ' 431' ' ' LEU . 76.1 m -99.74 13.44 33.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.485 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 56.7 m -117.27 152.66 34.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.526 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -135.18 136.99 42.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.908 -0.404 . . . . 10.0 109.908 179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 2.8 m -85.2 117.05 29.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.2 0.524 . . . . 10.0 111.86 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.567 ' HB3' ' HB2' ' D' ' 409' ' ' LYS . 65.9 m-85 -120.45 122.68 41.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.494 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.641 ' HA ' ' HG ' ' D' ' 426' ' ' LEU . 11.7 ptm180 -81.11 -172.96 4.03 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.647 -0.251 . . . . 10.0 110.614 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . 0.601 HD13 ' HG3' ' D' ' 425' ' ' GLU . 30.7 tp -70.37 145.88 50.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.73 0.3 . . . . 10.0 110.45 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.77 93.3 0.53 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.712 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -76.97 84.78 3.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.93 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 58.2 36.04 25.46 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.647 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.418 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 5.4 t-80 -85.91 156.93 20.3 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.429 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.04 -37.38 87.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.397 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 162.31 43.64 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.131 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.9 ttpp -141.08 140.67 34.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 10.0 110.697 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.567 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 10.4 pttt -70.09 144.68 52.03 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.863 -0.608 . . . . 10.0 110.635 179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . 0.457 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -97.41 118.99 35.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.733 0.301 . . . . 10.0 110.987 -179.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -78.37 136.53 37.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.269 -0.423 . . . . 10.0 111.299 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' D' ' 412' ' ' LEU . 12.4 mt -119.03 -166.81 1.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.22 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -102.26 167.17 10.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.332 -0.395 . . . . 10.0 110.05 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -85.26 -22.7 28.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.008 0.432 . . . . 10.0 111.217 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -92.83 16.84 11.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.993 0.425 . . . . 10.0 111.281 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.488 ' HB ' HD12 ' D' ' 378' ' ' LEU . 6.3 m -71.7 139.9 49.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.128 -0.487 . . . . 10.0 110.638 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -77.61 143.47 38.24 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.232 -0.284 . . . . 10.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -91.55 -19.17 23.04 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.909 0.707 . . . . 10.0 112.909 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.06 -34.64 66.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.79 0.329 . . . . 10.0 111.422 -179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 16.2 m -69.28 -25.16 64.11 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.28 -0.418 . . . . 10.0 111.937 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 8.1 mp -100.41 35.73 2.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.994 0.426 . . . . 10.0 111.098 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 7.2 tt -59.93 119.5 4.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.737 -0.665 . . . . 10.0 112.117 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 97.52 -8.65 64.26 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.973 -0.632 . . . . 10.0 113.519 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . 0.463 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 42.2 tt0 -89.36 149.83 22.83 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.234 0.517 . . . . 10.0 111.089 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' D' ' 401' ' ' LEU . 1.5 pt-20 -104.61 95.02 5.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.172 0.511 . . . . 10.0 110.569 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' D' ' 400' ' ' ARG . 3.2 tt -90.27 135.11 33.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.859 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . 0.411 ' HG3' ' HB3' ' D' ' 361' ' ' PHE . 15.7 tt0 -116.27 141.12 48.57 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.958 0.409 . . . . 10.0 111.095 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 21.6 t -110.99 93.84 2.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.097 0.475 . . . . 10.0 109.73 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -87.61 176.69 7.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.672 -0.694 . . . . 10.0 109.951 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -92.48 167.27 12.07 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.749 0.309 . . . . 10.0 110.631 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.462 ' CD2' ' HA ' ' D' ' 395' ' ' CYS . 0.8 OUTLIER -70.02 152.46 44.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 10.0 111.694 179.68 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -80.64 101.21 9.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.458 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -163.1 90.9 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.425 -0.352 . . . . 10.0 110.564 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 32.7 t 63.19 95.95 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.602 0.564 . . . . 10.0 112.402 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.71 -174.91 2.34 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.932 2.422 . . . . 10.0 112.483 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 80.7 mt 75.35 147.16 0.09 Allowed 'General case' 0 N--CA 1.472 0.625 0 CA-C-N 115.517 -0.765 . . . . 10.0 112.375 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 2.1 m -107.12 150.59 26.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.916 0.389 . . . . 10.0 110.493 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 2.1 p -122.99 179.55 4.62 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.249 179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 62.6 t60 -96.3 160.15 14.58 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.509 -0.552 . . . . 10.0 109.509 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -141.54 120.18 12.53 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.682 -0.488 . . . . 10.0 109.682 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.45 95.53 2.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.414 -0.357 . . . . 10.0 111.698 -179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.51 118.47 36.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.759 -0.46 . . . . 10.0 109.759 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -90.99 86.36 6.24 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.303 0.573 . . . . 10.0 111.526 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -145.25 153.49 41.36 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.724 179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.5 165.59 16.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.75 -0.659 . . . . 10.0 112.41 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -105.69 -175.11 2.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.696 -0.684 . . . . 10.0 110.113 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 79.9 mt -125.05 -50.6 1.69 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.355 0.598 . . . . 10.0 109.941 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -92.49 139.66 30.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.736 -0.666 . . . . 10.0 110.395 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . 0.505 ' HB2' ' H62' ' D' ' 501' ' ' PCW . 61.3 tp -80.98 128.72 34.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 120.868 0.366 . . . . 10.0 110.345 179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -139.29 177.46 7.9 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 38.4 m-85 -107.39 168.76 9.01 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.801 ' HA ' HD23 ' D' ' 459' ' ' LEU . 15.3 t -76.2 135.5 39.73 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -92.24 -3.44 55.51 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.839 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 3.0 mm -116.64 -18.68 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.743 -0.662 . . . . 10.0 111.099 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 5.4 m -130.16 -177.49 4.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.865 0.365 . . . . 10.0 111.551 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -102.81 33.19 3.32 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.077 -0.51 . . . . 10.0 110.997 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.42 179.39 5.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.335 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . 0.537 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 9.5 p90 -83.92 158.51 21.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.809 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' D' ' 471' ' ' LYS . 0.2 OUTLIER -97.02 105.05 17.12 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.178 0.513 . . . . 10.0 111.327 -179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.712 HD13 H121 ' D' ' 501' ' ' PCW . 0.4 OUTLIER -92.83 -151.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.499 -0.773 . . . . 10.0 109.42 179.122 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.71 78.98 2.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.024 0.44 . . . . 10.0 111.154 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -106.98 -114.3 3.87 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.833 -0.699 . . . . 10.0 112.297 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -129.25 154.77 46.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.651 0.262 . . . . 10.0 111.025 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -155.64 174.45 15.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.85 -0.614 . . . . 10.0 109.798 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -123.89 160.16 28.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.781 0.324 . . . . 10.0 111.079 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -91.42 -41.05 11.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.58 -61.29 1.89 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.448 -0.342 . . . . 10.0 111.148 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.49 -68.54 0.52 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.009 -0.542 . . . . 10.0 111.068 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 102.11 48.37 1.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 10.0 112.427 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -85.87 167.35 15.23 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.069 -0.345 . . . . 10.0 110.069 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.808 ' HB2' ' HG ' ' D' ' 459' ' ' LEU . 4.7 pttp -133.76 112.53 11.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.143 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.748 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 25.9 p90 -150.93 167.56 27.21 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . 0.477 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 37.9 m80 -91.9 -175.81 4.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.43 -45.53 79.57 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.842 -0.617 . . . . 10.0 109.985 178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -67.47 -28.04 67.53 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.909 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.748 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 7.1 m -75.33 -20.68 58.91 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.223 0.453 . . . . 10.0 112.223 -179.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 50.7 m -50.88 -45.31 60.04 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.552 0.532 . . . . 10.0 111.874 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 2.0 m -115.15 35.79 4.19 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.556 0.694 . . . . 10.0 109.742 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.695 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 76.9 tttt -119.33 -35.57 3.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.263 -0.881 . . . . 10.0 110.369 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . . . . . . . . . 7.0 p -76.95 122.44 86.42 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.0 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.34 -26.14 5.21 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.29 1.994 . . . . 10.0 112.394 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 2.0 m -89.33 109.9 20.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.261 -0.427 . . . . 10.0 110.625 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 44.4 tpp -81.53 159.69 24.09 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.868 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.1 m -68.01 91.36 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.911 0.386 . . . . 10.0 111.301 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 28.6 t -131.76 86.82 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.961 -0.563 . . . . 10.0 109.722 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -88.81 150.15 23.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.878 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.056 ' H62' ' H2 ' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 0.981 H231 H262 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.088 ' H82' ' H11' ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.094 H351 H162 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.258 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.863 H411 ' C38' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.094 H162 H351 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.002 H341 ' H59' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.041 ' H29' ' H39' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 1.047 ' H1 ' ' H63' ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.061 H362 H371 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 1.105 H431 H472 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.091 H431 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 1.085 H271 H271 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.048 H431 ' H19' ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.077 H122 ' H9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.17 H322 ' O31' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.975 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.069 H131 ' H60' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.049 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.078 H451 H181 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.109 H182 H362 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.078 H181 H451 ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.023 H431 ' H34' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 0.812 ' H2 ' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.927 H283 ' H68' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.067 ' H19' H371 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.095 H212 H172 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.109 H362 H182 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 1.078 H442 ' H20' ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.026 H452 H262 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.118 H441 H232 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 0.996 H272 H232 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.08 H131 H151 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.078 ' H20' H442 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.847 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.114 H421 ' H62' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.066 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.17 ' O31' H322 ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.039 H461 ' H40' ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.105 H472 H431 ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.118 H232 H441 ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.028 ' H57' H19A ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.095 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.801 ' H67' ' C23' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 0.867 ' H51' ' H57' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.077 ' H9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 0.996 ' H55' H451 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.014 ' H41' H211 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.048 H342 H121 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.062 ' H41' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.066 H283 H20A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.027 H151 H341 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.098 ' H52' H10A ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.094 H412 H11A ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.026 H262 H452 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.094 ' H32' ' O4P' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 1.088 ' H11' ' H82' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.056 ' C22' H242 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.024 H231 H271 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.012 H241 ' H20' ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.094 H11A H412 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.098 H10A ' H52' ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.114 ' H62' H421 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.763 ' O2G' 'MG ' ' B' ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . 0.763 'MG ' ' O2G' ' B' ' 216' ' ' GNP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.06 ' H39' H441 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.047 ' H63' ' H1 ' ' A' ' 410' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 0.999 H251 H211 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.053 H122 H171 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.017 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 0.994 H242 ' H20' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 0.958 H242 H472 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.091 H382 H232 ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.066 ' H63' H321 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.066 H321 ' H63' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.045 ' H51' H212 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 0.963 ' H33' ' H2 ' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 0.983 ' H12' ' H65' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 0.929 ' H78' H242 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.049 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.066 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 29.6 mt . . . . . 0 CA--C 1.519 -0.239 0 CA-C-O 120.899 0.38 . . . . 10.0 111.046 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . 0.596 ' HE3' H282 ' A' ' 415' ' ' PCW . 7.3 tmtm? -58.16 -40.78 82.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.1 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 46.2 mt -67.19 -54.17 23.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.887 -0.597 . . . . 10.0 111.559 -179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 84.6 mt -61.83 -42.51 99.11 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 10.0 112.617 -179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -62.84 -48.4 79.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 10.0 110.769 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 210' ' ' VAL . 0.9 OUTLIER -68.7 -32.17 71.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.867 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 68.3 t90 -62.6 -41.59 99.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -61.67 -37.69 85.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.459 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.5 m -65.18 -26.49 68.17 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.96 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 206' ' ' ASN . 46.1 t -81.99 -45.05 20.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 5.3 m -56.72 -45.33 81.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.803 -0.635 . . . . 10.0 111.334 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 2.5 p -61.15 -35.79 78.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.822 0.344 . . . . 10.0 111.257 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.4 m -69.87 -38.74 76.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -62.86 -41.87 99.53 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.326 -0.62 . . . . 10.0 109.326 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . . . . . . . . . 6.6 m -61.24 -46.72 89.24 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.925 -0.579 . . . . 10.0 109.763 178.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 64.1 mmtt -63.32 -40.72 98.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.449 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.3 -47.36 79.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.285 179.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . 0.402 ' HA ' HD12 ' A' ' 221' ' ' LEU . 65.1 mtt180 -63.6 -35.14 79.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.544 -0.298 . . . . 10.0 110.989 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -70.75 -26.75 63.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 10.0 110.679 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -88.5 -32.79 18.04 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.301 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 218' ' ' ARG . 36.0 mt -55.37 -36.64 66.55 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.897 -0.592 . . . . 10.0 111.131 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -55.59 -69.84 1.15 Allowed Glycine 0 CA--C 1.517 0.216 0 N-CA-C 111.007 -0.837 . . . . 10.0 111.007 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -51.55 -41.12 62.18 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.986 2.457 . . . . 10.0 111.409 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.94 -49.68 83.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-N 116.463 -0.335 . . . . 10.0 111.517 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 11.9 p -68.52 -34.26 75.57 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.691 -0.404 . . . . 10.0 110.695 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -63.63 -41.6 98.24 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.788 -0.449 . . . . 10.0 109.788 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -74.82 -32.46 61.97 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.995 -0.742 . . . . 10.0 108.995 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.544 ' HZ ' H483 ' A' ' 402' ' ' PCW . 26.5 t80 -63.34 -50.33 70.39 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.743 -0.662 . . . . 10.0 109.9 178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.458 ' HA ' ' HE3' ' A' ' 229' ' ' TRP . 3.6 m95 -64.26 -34.26 77.7 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.257 0.551 . . . . 10.0 109.709 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.22 -50.31 68.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.551 -0.749 . . . . 10.0 110.432 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.797 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 49.0 m-20 -67.69 -37.63 82.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.421 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 232' ' ' LEU . 7.4 mt -65.95 -29.63 70.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.413 -0.358 . . . . 10.0 110.262 178.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.416 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 4.4 mm-40 -66.66 -32.41 73.71 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.667 -0.494 . . . . 10.0 109.667 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.797 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 43.6 mttt -69.89 -38.0 76.2 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -71.77 -46.08 59.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.477 -0.783 . . . . 10.0 110.399 178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 2.9 p -64.43 -40.88 96.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.446 -0.343 . . . . 10.0 110.829 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.471 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 12.4 tt0 -61.23 -42.79 99.23 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.849 -0.426 . . . . 10.0 109.849 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -61.18 -45.05 97.3 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 109.963 -1.255 . . . . 10.0 109.963 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 84.7 mt -64.78 -32.03 73.53 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.739 0.304 . . . . 10.0 111.152 178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.471 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 56.5 mtt180 -65.09 -40.22 94.3 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.483 -0.562 . . . . 10.0 109.483 178.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -72.47 -42.1 65.31 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.375 -0.83 . . . . 10.0 109.418 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -63.41 -32.49 73.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.818 -0.628 . . . . 10.0 109.602 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.936 ' HG3' HD12 ' A' ' 247' ' ' LEU . 51.5 ttm -64.73 -34.51 78.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.415 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . 0.402 ' HA ' ' HG2' ' A' ' 248' ' ' GLU . 10.5 m -83.46 8.99 12.21 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.795 -0.639 . . . . 10.0 111.136 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 29.6 mttm -128.62 -66.43 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.383 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.451 ' O ' ' HB ' ' A' ' 250' ' ' VAL . 6.1 t0 -59.7 -54.7 43.33 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.731 -0.668 . . . . 10.0 110.95 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.936 HD12 ' HG3' ' A' ' 243' ' ' MET . 31.0 mt -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.5 0.555 . . . . 10.0 112.5 -179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . 0.402 ' HG2' ' HA ' ' A' ' 244' ' ' SER . 60.8 mm-40 -76.68 -50.64 13.2 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.894 0.378 . . . . 10.0 110.087 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -69.77 -28.41 65.74 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.699 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.713 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 1.4 p -66.06 -26.73 39.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 N-CA-C 109.545 -0.539 . . . . 10.0 109.545 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.433 ' O ' HG12 ' A' ' 254' ' ' VAL . 77.5 mttt -88.39 -40.1 13.78 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.774 178.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.18 -41.4 98.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.789 -0.641 . . . . 10.0 109.912 179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -86.19 -13.53 46.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.118 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -69.07 -27.1 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-O 120.737 0.303 . . . . 10.0 110.24 179.414 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.552 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 22.6 mt-30 -58.58 -61.2 8.12 Favored Pre-proline 0 C--O 1.233 0.23 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.449 179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.552 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 43.8 Cg_endo -70.08 -28.82 23.24 Favored 'Trans proline' 0 C--N 1.356 0.946 0 C-N-CA 121.826 1.684 . . . . 10.0 111.444 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . 0.42 ' HB2' ' HA ' ' A' ' 254' ' ' VAL . 3.2 m-30 -63.19 -52.91 60.41 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.748 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 87.6 mt -67.95 -34.6 76.89 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.775 179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -59.87 -44.79 93.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.131 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.38 -52.0 63.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.985 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . 0.453 ' O ' ' HB2' ' A' ' 265' ' ' TRP . 37.4 m-85 -62.54 -43.22 99.35 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.59 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -64.67 -41.57 95.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.372 . . . . 10.0 110.504 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . 0.524 ' O ' ' HG3' ' A' ' 267' ' ' GLU . 2.3 ttmp? -62.87 -50.39 71.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.138 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.553 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 75.7 mttt -62.76 -42.01 99.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.935 179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.453 ' HB2' ' O ' ' A' ' 261' ' ' PHE . 0.2 OUTLIER -64.26 -33.49 75.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.211 179.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -63.06 -47.35 83.31 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.944 -0.762 . . . . 10.0 108.944 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 263' ' ' LYS . 45.0 mt-10 -64.99 -41.71 95.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.801 -0.636 . . . . 10.0 109.6 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.509 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 12.9 mt-10 -57.98 -43.92 86.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.256 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 77.7 mmm -71.17 -39.65 71.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.967 -0.561 . . . . 10.0 110.733 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 274' ' ' GLN . 5.2 mt-10 -60.17 -47.85 84.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 110.073 -0.343 . . . . 10.0 110.073 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 54.7 mt -63.7 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.959 -0.564 . . . . 10.0 109.661 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -62.66 -45.56 92.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.49 -0.777 . . . . 10.0 109.902 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.585 ' HA ' HG12 ' A' ' 276' ' ' VAL . 91.5 mtt180 -72.01 -37.49 69.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 10.0 111.107 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 270' ' ' GLU . 0.0 OUTLIER -64.43 -30.92 71.95 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.826 179.948 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.723 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 8.9 mptt -93.11 -39.23 11.17 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 116.222 -0.444 . . . . 10.0 112.079 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 273' ' ' ARG . 3.2 p -55.83 -32.31 31.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 N-CA-C 113.09 0.774 . . . . 10.0 113.09 -178.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.764 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 26.1 mt-10 -65.88 -60.57 6.97 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.991 -0.284 . . . . 10.0 111.648 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.764 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 51.9 Cg_exo -58.81 -36.78 96.47 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.199 1.933 . . . . 10.0 111.145 178.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.799 HD22 ' HE3' ' C' ' 495' ' ' LYS . 48.2 mt -66.16 -39.08 89.52 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.618 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ttm105 -60.76 -39.56 89.23 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.528 -0.545 . . . . 10.0 109.528 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -65.78 -45.83 80.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 10.0 109.959 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.38 -44.84 95.52 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.86 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 49.8 mt -64.85 -33.11 75.22 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.042 -0.526 . . . . 10.0 110.681 179.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -69.64 -48.67 59.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.218 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.35 -42.6 98.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.238 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -63.2 -48.08 82.6 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 110.705 -0.958 . . . . 10.0 110.705 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -61.8 -38.59 88.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 110.34 -0.244 . . . . 10.0 110.34 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -57.82 -51.84 67.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.681 0.277 . . . . 10.0 110.552 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.5 -43.72 96.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.862 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 294' ' ' LEU . 72.4 mttt -65.0 -42.77 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 10.0 111.54 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 81.9 mt -68.93 -40.28 79.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.796 0.332 . . . . 10.0 110.235 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -66.72 -34.17 77.25 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.775 -0.454 . . . . 10.0 109.775 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -64.06 -36.24 83.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 290' ' ' LYS . 91.5 mt -70.58 -44.3 67.63 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.302 -0.863 . . . . 10.0 109.452 178.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -60.14 -40.93 91.53 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.002 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -63.81 -13.51 45.02 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.331 -0.395 . . . . 10.0 111.652 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 30.2 mmtp -108.96 -39.26 5.36 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.443 178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . . . . . . . . . 52.7 mt -61.85 -30.52 70.91 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.087 0.403 . . . . 10.0 112.087 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 2.8 m -72.84 -64.1 0.96 Allowed Pre-proline 0 CA--C 1.54 0.592 0 N-CA-C 112.492 0.553 . . . . 10.0 112.492 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 40.3 Cg_endo -68.85 -47.91 1.11 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 121.703 1.602 . . . . 10.0 113.039 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.769 HD13 ' HG2' ' C' ' 473' ' ' LYS . 94.0 mt -68.49 -27.55 66.23 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.581 0.229 . . . . 10.0 110.481 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . . . . . . . . . . . -68.35 -45.96 66.45 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 110.31 -1.116 . . . . 10.0 110.31 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -63.08 -44.34 96.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.916 -0.402 . . . . 10.0 109.916 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -40.45 91.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.715 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . 0.43 ' SD ' HD13 ' C' ' 469' ' ' LEU . 9.7 tpt -61.89 -41.22 97.63 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.219 -0.66 . . . . 10.0 109.219 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.559 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 53.6 mtt180 -67.06 -38.72 86.3 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.893 -0.594 . . . . 10.0 109.401 178.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -60.38 -47.99 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.802 -0.635 . . . . 10.0 109.762 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . 0.671 ' HG3' HD21 ' C' ' 469' ' ' LEU . 22.6 mmt180 -66.87 -36.26 81.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.734 178.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 313' ' ' VAL . . . -63.41 -38.01 89.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.841 -0.618 . . . . 10.0 109.407 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 59.3 mtt180 -62.34 -43.02 99.8 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 109.177 -0.675 . . . . 10.0 109.177 178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -65.17 -39.55 93.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 10.0 109.6 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -58.8 -52.69 64.65 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.826 -0.625 . . . . 10.0 109.76 178.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' ' 316' ' ' LEU . 37.2 t -69.71 -32.52 52.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.999 -179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . 0.411 ' HA ' ' NH1' ' A' ' 317' ' ' ARG . 21.9 t70 -64.01 -49.29 73.01 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.002 -0.37 . . . . 10.0 110.002 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -62.65 -34.4 77.01 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.459 ' HG ' ' HE3' ' C' ' 462' ' ' LYS . 12.6 mt -65.5 -50.38 65.48 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.664 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 314' ' ' ASP . 15.8 mtm105 -60.58 -46.01 91.82 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.897 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 16.8 m -63.7 -25.62 68.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.004 -0.544 . . . . 10.0 111.341 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -91.58 -33.89 14.95 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.944 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 2.2 mt -60.88 -41.02 95.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.55 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . . . . . . . . . . . -54.23 -60.88 6.42 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 112.561 0.578 . . . . 10.0 112.561 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -67.52 -31.21 34.32 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.907 1.738 . . . . 10.0 112.342 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -65.81 -52.79 47.7 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 121.148 -0.221 . . . . 10.0 110.715 179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 53.7 p -66.43 -33.42 75.67 Favored 'General case' 0 C--N 1.328 -0.347 0 O-C-N 123.472 0.482 . . . . 10.0 110.689 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 10.0 t70 -56.93 -52.83 63.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.257 0.551 . . . . 10.0 109.721 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -69.56 -29.8 67.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.639 -0.71 . . . . 10.0 110.716 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.429 HD23 ' HD2' ' A' ' 330' ' ' ARG . 27.6 mt -64.92 -34.39 78.3 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 67.9 mtt180 -69.66 -38.55 77.14 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 108.796 -0.816 . . . . 10.0 108.796 177.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 69.8 mt-30 -64.28 -43.17 95.64 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.582 -0.896 . . . . 10.0 108.582 178.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.78 HH21 ' HB3' ' C' ' 447' ' ' GLU . 26.9 mtt-85 -61.33 -48.92 79.13 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.06 -0.973 . . . . 10.0 109.544 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 19.9 mt -60.08 -42.0 93.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.758 -0.656 . . . . 10.0 110.648 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.98 83.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.092 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.49 98.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.638 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -65.25 -41.35 94.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.27 -39.98 95.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.131 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.42 -41.57 96.52 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.75 95.28 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.085 -0.709 . . . . 10.0 109.085 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . 0.412 ' O ' ' HA3' ' A' ' 342' ' ' GLY . 16.2 mt -68.71 -20.96 64.43 Favored 'General case' 0 C--O 1.225 -0.206 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.479 178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -85.43 -42.9 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.734 -0.469 . . . . 10.0 109.734 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -67.72 -57.63 6.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.423 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.3 t-20 -67.86 -41.02 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 10.0 109.789 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . 0.412 ' HA3' ' O ' ' A' ' 338' ' ' LEU . . . -60.24 -46.84 93.54 Favored Glycine 0 N--CA 1.453 -0.184 0 C-N-CA 121.059 -0.591 . . . . 10.0 111.732 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . 0.407 ' HA2' HD12 ' A' ' 346' ' ' LEU . . . -61.5 -35.68 91.43 Favored Glycine 0 N--CA 1.452 -0.258 0 N-CA-C 110.837 -0.905 . . . . 10.0 110.837 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -67.83 -43.48 79.46 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.63 -0.508 . . . . 10.0 109.63 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 31.6 mtm180 -64.29 -38.65 91.81 Favored 'General case' 0 C--O 1.222 -0.356 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.246 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . 0.407 HD12 ' HA2' ' A' ' 343' ' ' GLY . 76.6 mt -61.63 -48.8 79.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.153 0.501 . . . . 10.0 109.807 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -60.23 -44.05 95.53 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.066 179.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.748 ' HB3' ' HE2' ' A' ' 352' ' ' LYS . 24.4 mt-10 -63.85 -47.16 81.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.267 -0.879 . . . . 10.0 110.191 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -55.35 -40.19 70.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.918 -0.583 . . . . 10.0 111.266 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -60.83 -44.69 96.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.989 0.423 . . . . 10.0 110.065 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -66.19 -45.77 79.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.914 -0.585 . . . . 10.0 109.989 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.748 ' HE2' ' HB3' ' A' ' 348' ' ' GLU . 40.3 mttm -59.16 -45.61 90.57 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.034 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -61.95 -37.82 86.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.407 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 70.1 m -66.68 -42.2 86.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 10.0 110.211 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -63.81 -39.41 94.17 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -64.8 -43.39 93.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.616 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 357' ' ' LEU . 29.8 mt -63.61 -41.56 98.29 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.365 -0.38 . . . . 10.0 111.387 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 72.4 m -62.15 -44.7 96.04 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.846 0.355 . . . . 10.0 110.099 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' C' ' 414' ' ' LYS . 3.2 m -74.42 -25.74 59.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.247 0.546 . . . . 10.0 110.549 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 65.1 tp -72.79 -29.69 63.48 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.383 -0.969 . . . . 10.0 108.383 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . 0.656 ' HB3' ' HE3' ' A' ' 365' ' ' LYS . 69.5 m -65.82 -28.42 68.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.529 -0.759 . . . . 10.0 109.257 178.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.402 ' C ' ' HD2' ' A' ' 366' ' ' PRO . 6.1 mm-40 -69.91 -19.38 63.41 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 70.1 mttt -96.02 -33.93 11.95 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.474 178.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -76.5 -30.37 57.2 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.536 -0.756 . . . . 10.0 112.563 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.981 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 52.5 mttt -103.97 -73.16 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.4 0.519 . . . . 10.0 112.4 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.981 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 31.3 Cg_exo -60.87 -56.8 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.153 1.902 . . . . 10.0 112.801 -179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.792 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.89 -46.63 87.39 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.242 0.46 . . . . 10.0 112.242 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' A' ' 368' ' ' LEU . 8.8 mt -64.45 -39.56 94.05 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 121.097 -0.241 . . . . 10.0 111.174 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -64.23 -45.2 89.26 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.627 -0.508 . . . . 10.0 109.627 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -61.23 -43.5 98.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 10.0 110.102 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.93 -48.83 72.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 10.0 110.858 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 80.9 mtt180 -59.36 -47.67 84.55 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.717 0.294 . . . . 10.0 111.369 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -69.39 -29.69 67.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 10.0 110.999 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -76.41 -30.8 56.19 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.744 -0.741 . . . . 10.0 111.96 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 379' ' ' LEU . 90.6 mt -79.26 -24.36 43.04 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 111.658 0.244 . . . . 10.0 111.658 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 379' ' ' LEU . 25.5 mt -52.08 -57.35 15.43 Favored Pre-proline 0 N--CA 1.466 0.366 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . 0.467 ' HG2' ' HE3' ' C' ' 400' ' ' LYS . 26.1 Cg_endo -64.47 -28.52 62.21 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 122.071 1.847 . . . . 10.0 110.92 178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.13 -41.59 92.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 108.891 -0.781 . . . . 10.0 108.891 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . 0.48 HD12 ' HA ' ' A' ' 376' ' ' LEU . 30.5 mt -61.86 -37.71 85.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.564 -0.743 . . . . 10.0 109.235 178.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 376' ' ' LEU . 42.4 mt-10 -62.88 -47.31 83.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.603 179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.48 -37.84 88.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.02 0.438 . . . . 10.0 110.581 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -67.59 -41.21 84.42 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.78 -0.645 . . . . 10.0 111.1 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . 0.403 ' O ' ' HG ' ' A' ' 387' ' ' LEU . 87.3 mttt -59.75 -45.95 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.941 -0.392 . . . . 10.0 109.941 178.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.19 -50.16 78.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.539 . . . . 10.0 111.449 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 5.9 p -64.4 -33.12 75.12 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.65 0.262 . . . . 10.0 111.587 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . 0.621 ' O ' ' HG ' ' A' ' 390' ' ' LEU . 2.3 m-85 -72.35 -49.45 34.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.49 -0.323 . . . . 10.0 110.656 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.466 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 89.0 mt -59.24 -46.5 88.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.091 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.659 ' HB2' ' HE3' ' C' ' 594' ' ' LYS . 24.1 p -62.75 -33.34 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.65 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 393' ' ' TYR . . . -72.41 -41.97 65.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.36 179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 386' ' ' PHE . 86.7 mt -57.61 -47.22 82.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.082 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 395' ' ' LYS . 34.8 mt-10 -67.83 -32.35 72.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.925 179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 388' ' ' SER . 3.5 tp10 -66.46 -44.37 82.96 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.719 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . 0.458 ' HD2' ' O ' ' A' ' 389' ' ' ALA . 28.7 m-85 -61.42 -52.27 65.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.442 -0.345 . . . . 10.0 111.253 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 1.3 m -64.62 -26.54 68.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.516 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . 0.476 ' HB2' ' O ' ' A' ' 391' ' ' GLU . 25.7 ttmt -68.6 -24.75 64.62 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.204 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 14.8 mptt -109.11 -34.33 6.62 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.203 0.445 . . . . 10.0 112.203 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -78.25 -24.93 46.67 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.749 0.309 . . . . 10.0 111.217 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 45.5 t30 . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.162 179.429 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.2 mm? . . . . . 0 CA--C 1.519 -0.233 0 CA-C-O 121.36 0.6 . . . . 10.0 110.195 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . 0.467 ' HE3' ' HG2' ' A' ' 377' ' ' PRO . 3.3 mtpm? -96.48 10.3 38.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.228 -0.896 . . . . 10.0 109.594 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 85.9 mt -61.21 -43.93 98.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.287 -0.87 . . . . 10.0 111.115 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . 0.447 ' HA ' ' HB2' ' C' ' 405' ' ' TRP . 4.8 mp -69.3 -28.89 66.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.074 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.03 -43.86 97.94 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 108.855 -0.795 . . . . 10.0 108.855 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.41 ' O ' HG23 ' C' ' 408' ' ' VAL . 24.6 t-20 -77.11 -37.46 54.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.254 -0.885 . . . . 10.0 110.096 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . 0.447 ' HB2' ' HA ' ' C' ' 402' ' ' LEU . 0.0 OUTLIER -57.87 -38.03 74.99 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.83 -0.623 . . . . 10.0 111.025 179.439 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -42.94 99.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.173 0.511 . . . . 10.0 109.873 178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -39.15 92.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.814 -0.63 . . . . 10.0 109.944 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.41 HG23 ' O ' ' C' ' 404' ' ' ASN . 97.1 t -64.21 -42.95 97.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 10.0 110.25 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 8.4 m -67.49 -39.6 85.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.031 179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 42.9 m -64.28 -40.67 96.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.277 -0.42 . . . . 10.0 110.786 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 1.6 p -69.02 -36.06 77.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.105 0.479 . . . . 10.0 110.276 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -65.61 -38.13 88.57 Favored 'General case' 0 C--O 1.226 -0.14 0 N-CA-C 109.207 -0.664 . . . . 10.0 109.207 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' C' ' 416' ' ' ARG . 19.8 m -63.49 -38.88 92.82 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.769 -0.651 . . . . 10.0 109.51 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.513 ' HB3' ' CG2' ' A' ' 359' ' ' THR . 47.5 mmtt -63.54 -32.83 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.108 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 78.8 mt -70.02 -41.87 73.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.842 -0.799 . . . . 10.0 108.842 178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.507 ' HD2' ' HA ' ' C' ' 413' ' ' SER . 87.9 mtt180 -62.34 -42.82 99.7 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.767 -0.651 . . . . 10.0 109.912 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' C' ' 413' ' ' SER . 43.0 mt-10 -57.85 -38.23 75.3 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.561 -0.745 . . . . 10.0 110.587 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -75.3 -45.65 38.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.886 -0.597 . . . . 10.0 110.312 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 415' ' ' LEU . 67.5 mt -46.87 -41.98 16.66 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 115.616 -0.72 . . . . 10.0 112.506 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -52.04 -77.41 0.14 Allowed Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.291 -0.48 . . . . 10.0 112.462 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -58.85 -38.92 85.99 Favored 'Trans proline' 0 CA--C 1.53 0.286 0 C-N-CA 122.788 2.325 . . . . 10.0 112.868 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 37.2 t -58.93 -45.02 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 N-CA-C 112.112 0.412 . . . . 10.0 112.112 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 32.4 p -69.1 -35.94 77.01 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.439 -0.504 . . . . 10.0 110.574 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -61.94 -52.38 64.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.211 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.36 -29.61 68.36 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.435 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.419 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 47.9 t80 -65.67 -42.21 91.6 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.754 -0.832 . . . . 10.0 108.754 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.436 ' O ' ' HG3' ' C' ' 431' ' ' GLU . 7.0 m95 -68.02 -39.55 83.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.87 178.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 30.6 t70 -63.89 -39.65 94.69 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.806 -0.813 . . . . 10.0 108.806 178.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.8 -40.13 91.59 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 108.895 -0.78 . . . . 10.0 108.895 177.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 40.9 mt -60.76 -41.91 96.37 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.492 -0.777 . . . . 10.0 110.034 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' C' ' 427' ' ' TRP . 27.9 mt-10 -63.04 -35.55 80.61 Favored 'General case' 0 C--O 1.231 0.114 0 N-CA-C 110.189 -0.3 . . . . 10.0 110.189 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 43.7 mttp -68.3 -41.86 80.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.42 -47.12 71.18 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.288 -0.869 . . . . 10.0 111.14 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 19.3 p -62.21 -54.45 40.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.792 -0.185 . . . . 10.0 110.663 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -59.14 -37.44 77.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.614 -0.267 . . . . 10.0 111.135 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -67.88 -48.25 55.9 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 110.63 -0.988 . . . . 10.0 110.63 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.79 -34.4 77.18 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.503 0.192 . . . . 10.0 110.525 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 61.1 mtt180 -63.98 -32.41 73.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.399 -0.364 . . . . 10.0 110.261 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -70.49 -36.97 74.14 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.609 -0.515 . . . . 10.0 109.609 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -74.1 -40.8 62.47 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 90.9 mmm -61.68 -46.54 89.26 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.426 -0.806 . . . . 10.0 111.575 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 3.1 p -60.27 -46.98 87.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.013 0.435 . . . . 10.0 110.323 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -62.05 -33.77 75.01 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.961 -0.563 . . . . 10.0 110.18 179.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.741 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 34.4 t0 -74.08 -54.6 7.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.916 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.463 ' O ' HG12 ' C' ' 448' ' ' VAL . 89.5 mt -63.09 -46.12 88.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 113.337 0.866 . . . . 10.0 113.337 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -66.35 -49.4 67.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.076 0.465 . . . . 10.0 111.465 -179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.78 ' HB3' HH21 ' A' ' 330' ' ' ARG . 20.1 tt0 -70.96 -25.72 62.85 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.55 -0.295 . . . . 10.0 111.264 -179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.769 HG22 HG23 ' C' ' 452' ' ' VAL . 0.3 OUTLIER -71.41 -22.32 22.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.861 0.362 . . . . 10.0 110.309 179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.6 mttt -67.44 -30.32 70.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.15 -1.056 . . . . 10.0 108.15 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -99.91 18.85 17.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.817 -1.083 . . . . 10.0 109.846 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' C' ' 448' ' ' VAL . 48.8 mttm -128.22 -49.39 1.31 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.828 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.769 HG23 HG22 ' C' ' 448' ' ' VAL . 41.2 t -64.56 -46.41 92.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.584 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -58.07 -57.31 26.86 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 112.864 0.69 . . . . 10.0 112.864 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.94 -31.68 84.55 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.808 1.672 . . . . 10.0 111.906 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 6.1 t80 -68.3 -40.98 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 34.8 mt -67.3 -34.19 76.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.951 -0.759 . . . . 10.0 108.951 178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -61.16 -51.62 68.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.715 -0.675 . . . . 10.0 109.544 178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . 0.471 ' O ' ' HG3' ' C' ' 462' ' ' LYS . 46.2 t0 -64.33 -41.58 96.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.297 179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.4 -46.72 87.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.367 179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -62.69 -33.73 75.67 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.931 0.396 . . . . 10.0 110.223 178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -64.36 -45.91 85.68 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.355 -0.609 . . . . 10.0 109.355 178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' C' ' 458' ' ' ASP . 38.3 mttm -67.34 -35.57 79.66 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.581 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . 0.435 ' O ' ' HB2' ' C' ' 467' ' ' MET . 25.3 m0 -62.94 -46.71 86.47 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 25.0 mt-30 -63.86 -46.22 85.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.241 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.698 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 40.7 mt-10 -57.1 -57.94 10.4 Favored 'General case' 0 CA--C 1.52 -0.181 0 O-C-N 123.544 0.527 . . . . 10.0 110.384 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.42 -37.12 77.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.353 -0.385 . . . . 10.0 111.044 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' C' ' 463' ' ' TRP . 39.1 ttm -62.68 -44.63 95.75 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.924 0.393 . . . . 10.0 109.946 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 29.7 mt-10 -67.38 -37.98 84.01 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.383 -0.599 . . . . 10.0 109.383 178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.698 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 87.4 mt -62.62 -39.16 92.93 Favored 'General case' 0 C--O 1.223 -0.325 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -66.58 -33.25 75.24 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.036 0.446 . . . . 10.0 109.996 178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.618 ' HA ' ' HG2' ' C' ' 475' ' ' GLU . 49.3 mtt180 -74.57 -17.92 60.66 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.057 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -107.42 0.46 22.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.819 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.769 ' HG2' HD13 ' A' ' 301' ' ' LEU . 60.3 mttp -129.56 -64.38 0.89 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.237 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.63 -42.21 93.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.501 -0.318 . . . . 10.0 111.137 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.618 ' HG2' ' HA ' ' C' ' 471' ' ' ARG . 29.2 mm-40 -58.74 -59.52 13.4 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.636 -0.256 . . . . 10.0 111.668 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -62.35 -34.45 77.11 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.754 1.636 . . . . 10.0 110.641 178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.73 -36.82 84.24 Favored 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 110.089 -0.337 . . . . 10.0 110.089 178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.68 ' O ' ' HB2' ' C' ' 482' ' ' GLN . 6.8 mtt180 -60.0 -36.82 78.02 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.335 -0.393 . . . . 10.0 110.056 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -79.16 -46.14 18.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.8 -0.636 . . . . 10.0 110.397 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.83 -46.28 91.17 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.84 0.352 . . . . 10.0 110.867 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 78.0 mt -69.21 -29.96 68.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 10.0 109.802 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . 0.68 ' HB2' ' O ' ' C' ' 478' ' ' ARG . 33.8 tt0 -69.27 -40.14 77.98 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 108.483 -0.932 . . . . 10.0 108.483 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.8 -44.03 91.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.381 -0.97 . . . . 10.0 108.381 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -63.29 -36.99 94.15 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 110.786 -0.926 . . . . 10.0 110.786 178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.99 72.01 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -59.81 -45.0 93.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.453 -0.943 . . . . 10.0 108.453 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . 0.501 ' HA ' ' OE1' ' C' ' 487' ' ' GLN . 11.2 mm-40 -66.43 -38.44 87.4 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.592 -0.731 . . . . 10.0 109.585 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -64.02 -41.51 97.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.545 . . . . 10.0 109.707 178.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 86.2 mt -66.99 -37.71 84.71 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 115.604 -0.726 . . . . 10.0 109.065 178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.45 -45.48 93.52 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 108.488 -0.93 . . . . 10.0 108.488 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' C' ' 487' ' ' GLN . 38.2 mt-10 -58.86 -51.26 70.77 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.436 -0.802 . . . . 10.0 108.893 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 83.5 mt -59.16 -45.25 91.48 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.681 -0.69 . . . . 10.0 111.222 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -58.82 -46.52 87.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.761 0.315 . . . . 10.0 111.24 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -78.71 -3.24 43.2 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.799 ' HE3' HD22 ' A' ' 279' ' ' LEU . 26.3 mttp -108.78 -46.56 3.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.783 0.325 . . . . 10.0 110.843 179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . . . . . . . . . 99.1 mt -64.11 -25.03 67.92 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.868 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' C' ' 501' ' ' GLU . 34.0 m -70.5 -66.45 0.82 Allowed Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 120.851 -0.339 . . . . 10.0 111.64 179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 36.3 Cg_endo -64.12 -43.67 14.52 Favored 'Trans proline' 0 C--N 1.354 0.856 0 C-N-CA 121.825 1.683 . . . . 10.0 112.255 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . . . . . . . . . 94.2 mt -70.04 -32.56 70.74 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.877 0.37 . . . . 10.0 110.466 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . . . . . . . . . . . -66.93 -45.21 85.45 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 110.715 -0.954 . . . . 10.0 110.715 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' C' ' 497' ' ' SER . 40.4 mm-40 -64.35 -39.15 93.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.789 -0.819 . . . . 10.0 108.789 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 19.5 tt0 -63.81 -45.2 90.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.393 -0.821 . . . . 10.0 109.851 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.567 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 81.6 mmm -60.87 -36.68 79.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.015 -0.539 . . . . 10.0 109.912 178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 72.1 mtt180 -67.23 -41.12 86.21 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.94 -0.573 . . . . 10.0 109.772 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.461 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 4.8 m-20 -65.43 -39.52 92.19 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.567 ' HD2' ' HA ' ' C' ' 503' ' ' MET . 47.4 mtt180 -61.6 -48.29 81.59 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 108.436 -0.95 . . . . 10.0 108.436 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -59.85 -40.66 89.3 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 115.307 -0.86 . . . . 10.0 109.76 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 68.2 mtt180 -60.3 -44.99 94.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 10.0 109.917 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.553 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.33 -36.92 85.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.204 -0.453 . . . . 10.0 110.874 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.571 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 18.0 m-70 -74.6 -52.07 12.78 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.455 -0.338 . . . . 10.0 110.804 179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 77.8 t -62.54 -43.35 98.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.417 -0.356 . . . . 10.0 111.766 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.805 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 19.7 t0 -60.54 -37.25 80.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 120.994 0.426 . . . . 10.0 109.855 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -69.18 -43.8 73.5 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.825 -0.806 . . . . 10.0 108.825 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 95.5 mt -56.81 -32.63 65.9 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.193 -0.458 . . . . 10.0 110.661 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.805 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 87.9 mtt180 -63.13 -36.66 84.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.25 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.3 8.4 42.43 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.58 -179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -121.46 -55.48 1.93 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.749 0.309 . . . . 10.0 111.355 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.98 -43.65 67.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.276 -0.42 . . . . 10.0 111.677 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.692 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -58.29 -57.16 28.22 Favored Pre-proline 0 CA--C 1.532 0.273 0 CA-C-O 119.563 -0.256 . . . . 10.0 111.394 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 51.0 Cg_exo -58.3 -41.12 69.53 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.0 1.8 . . . . 10.0 110.774 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.48 ' O ' ' HG ' ' C' ' 525' ' ' LEU . 27.9 t80 -59.95 -41.78 92.6 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.326 -0.397 . . . . 10.0 109.985 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 22.8 m -66.31 -36.5 83.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.168 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.542 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 17.9 t70 -67.57 -40.42 84.87 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 109.659 -0.497 . . . . 10.0 109.659 178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -65.41 -36.92 85.4 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.121 -1.066 . . . . 10.0 108.121 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' C' ' 521' ' ' TYR . 59.9 mt -64.65 -30.44 71.46 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.167 -0.924 . . . . 10.0 109.218 178.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.542 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 70.1 mtt180 -66.98 -37.47 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.119 -0.491 . . . . 10.0 109.728 178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -67.21 -48.4 67.99 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -63.51 -41.2 98.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.289 -0.868 . . . . 10.0 110.157 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . . . . . . . . . 14.8 mt -64.82 -38.7 91.87 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.348 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -62.97 -45.5 92.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.056 0.455 . . . . 10.0 109.792 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.06 -43.63 86.91 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.757 -0.656 . . . . 10.0 109.836 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.546 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 17.5 mtt180 -62.46 -48.49 79.39 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.356 178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . 0.67 HD23 HD12 ' C' ' 536' ' ' LEU . 21.1 mt -63.29 -34.67 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.436 -0.347 . . . . 10.0 110.381 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -62.02 -45.9 91.57 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.897 -0.779 . . . . 10.0 108.897 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -66.69 -36.45 82.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.51 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.67 HD12 HD23 ' C' ' 533' ' ' LEU . 95.8 mt -68.39 -26.48 65.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.668 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -86.97 -36.64 18.16 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.781 -0.451 . . . . 10.0 109.781 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.06 -55.57 12.07 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 109.135 -0.691 . . . . 10.0 109.135 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -71.3 -29.49 65.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.583 -0.735 . . . . 10.0 109.18 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.513 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -67.23 -51.31 39.09 Favored Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.022 -0.831 . . . . 10.0 111.022 179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -58.0 -41.83 94.6 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 110.945 -0.862 . . . . 10.0 110.945 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' C' ' 546' ' ' GLU . . . -65.15 -43.03 93.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.53 -0.544 . . . . 10.0 109.53 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 38.3 mtt85 -65.02 -32.53 74.3 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.635 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 59.7 mt -66.71 -40.01 88.27 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.462 -0.94 . . . . 10.0 108.462 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.691 -0.855 . . . . 10.0 108.691 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' C' ' 542' ' ' ALA . 94.3 mt-10 -61.65 -44.15 97.52 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 108.949 -0.76 . . . . 10.0 108.949 178.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -60.96 -47.06 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.311 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -62.51 -44.26 96.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.503 -0.317 . . . . 10.0 110.653 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.472 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -59.97 -52.45 65.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.05 -0.523 . . . . 10.0 109.591 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.33 72.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.788 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -64.48 -49.41 71.5 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.139 -0.482 . . . . 10.0 109.888 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.55 -37.44 87.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.486 -0.325 . . . . 10.0 110.615 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 63.0 mt-10 -68.41 -38.89 81.66 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 116.103 -0.499 . . . . 10.0 110.036 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -71.59 -36.66 70.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.095 -0.502 . . . . 10.0 109.671 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 20.0 tp -65.68 -41.53 92.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.145 -0.479 . . . . 10.0 110.368 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 3.2 p -69.09 -37.59 78.5 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 121.067 -0.253 . . . . 10.0 110.672 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.8 p -72.14 -35.9 69.21 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.913 -0.402 . . . . 10.0 109.913 178.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.03 -46.97 86.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.947 -0.57 . . . . 10.0 109.51 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 2.9 p -69.32 -36.63 77.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.444 . . . . 10.0 110.801 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -62.29 -27.51 69.08 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.412 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.25 -38.82 10.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.555 -0.748 . . . . 10.0 110.73 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -61.31 -43.06 99.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.17 -0.468 . . . . 10.0 112.223 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -55.18 -61.75 5.44 Favored Pre-proline 0 C--N 1.331 -0.227 0 N-CA-C 112.335 0.495 . . . . 10.0 112.335 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 26.0 Cg_endo -63.14 -33.6 72.07 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.974 1.783 . . . . 10.0 111.652 179.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.75 -45.06 88.02 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.315 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 51.9 mt -63.74 -44.56 93.16 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.776 -0.453 . . . . 10.0 109.776 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -62.56 -49.3 75.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 10.0 109.973 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.2 OUTLIER -61.79 -41.89 98.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.971 -0.559 . . . . 10.0 111.291 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.84 -45.42 82.29 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.91 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -67.57 -44.97 76.9 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.586 -0.279 . . . . 10.0 110.928 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -69.7 -19.19 63.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.673 0.273 . . . . 10.0 111.229 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.87 -35.99 6.57 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.702 -0.959 . . . . 10.0 110.702 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' C' ' 576' ' ' VAL . 30.9 mt -73.14 -34.16 65.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.65 -0.275 . . . . 10.0 111.334 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 39.1 mt -50.72 -60.47 5.39 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 112.255 0.465 . . . . 10.0 112.255 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -72.16 -39.34 3.1 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 121.691 1.594 . . . . 10.0 112.086 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' C' ' 573' ' ' LEU . 0.4 OUTLIER -62.45 -38.13 80.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 112.307 0.484 . . . . 10.0 112.307 -179.187 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 50.7 mt -67.9 -31.82 71.88 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.109 -0.33 . . . . 10.0 110.109 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.444 ' O ' HG23 ' C' ' 582' ' ' VAL . 68.4 mm-40 -72.92 -38.31 66.89 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.034 -0.728 . . . . 10.0 109.034 178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 17.2 m -65.26 -42.27 93.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.857 -0.794 . . . . 10.0 108.857 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -60.59 -37.68 82.15 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.906 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -60.87 -38.99 87.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 10.0 110.618 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 578' ' ' GLU . 25.2 t -63.91 -45.13 97.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 10.0 110.022 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.92 -23.56 61.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.513 . . . . 10.0 111.502 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -80.85 -48.6 12.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 10.0 110.425 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 45.9 mt -60.19 -47.64 85.07 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.952 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 21.4 p -62.0 -41.52 98.14 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 120.739 0.304 . . . . 10.0 110.462 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -59.54 -48.69 80.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.177 -0.465 . . . . 10.0 110.511 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 85.7 mt -58.72 -41.75 87.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.914 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 99.8 mt-10 -65.54 -53.76 37.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.692 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.28 -27.19 68.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 112.469 0.544 . . . . 10.0 112.469 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.506 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 1.6 m-30 -75.44 -45.59 37.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.483 -0.191 . . . . 10.0 110.483 179.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 25.5 m -60.74 -31.52 70.83 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.491 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 84.9 mttt -63.93 -41.16 97.7 Favored 'General case' 0 N--CA 1.457 -0.077 0 CA-C-N 116.102 -0.499 . . . . 10.0 110.973 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.659 ' HE3' ' HB2' ' A' ' 388' ' ' SER . 50.1 mttp -80.68 -39.96 26.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.934 -0.576 . . . . 10.0 111.359 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 88.5 mt -86.15 34.46 0.62 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.056 0.455 . . . . 10.0 111.59 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.439 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptm . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.734 0.302 . . . . 10.0 110.592 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.486 ' HB ' ' HE2' ' B' ' 4' ' ' TYR . 0.0 OUTLIER -76.39 107.98 9.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.002 0.43 . . . . 10.0 111.58 -179.259 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.697 ' HG3' HD22 ' B' ' 52' ' ' LEU . 32.7 tt0 -94.19 130.96 40.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.329 -0.396 . . . . 10.0 111.338 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . 0.486 ' HE2' ' HB ' ' B' ' 2' ' ' THR . 82.1 m-85 -126.38 135.12 51.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.195 -0.457 . . . . 10.0 109.788 179.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -90.51 113.57 25.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.767 0.318 . . . . 10.0 110.582 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.602 HD22 HD23 ' B' ' 159' ' ' LEU . 38.3 mt -113.87 122.64 47.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.698 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.463 HG11 ' HG3' ' B' ' 72' ' ' MET . 58.7 t -116.62 127.77 74.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.423 -0.584 . . . . 10.0 109.423 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -110.31 124.07 66.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 120.836 0.35 . . . . 10.0 111.522 -178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.52 152.95 38.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.957 -0.565 . . . . 10.0 109.882 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 173.42 -169.46 42.57 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.755 -0.736 . . . . 10.0 111.48 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.92 159.1 25.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.434 0.159 . . . . 10.0 110.73 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -80.68 121.33 5.4 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.834 -0.698 . . . . 10.0 112.567 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 108.59 14.34 16.2 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 121.147 -0.549 . . . . 10.0 112.454 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.436 ' HA ' ' HB2' ' B' ' 83' ' ' ALA . 19.9 m -93.86 -6.44 10.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 111.956 0.354 . . . . 10.0 111.956 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.37 27.87 29.09 Favored Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.355 -0.926 . . . . 10.0 111.194 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.474 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 19.7 ttpp -58.62 -50.26 74.48 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.232 -0.484 . . . . 10.0 110.725 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 58.2 m -69.87 -41.04 75.34 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 10.0 110.277 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.16 -43.64 78.52 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.676 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 74.5 mt -56.95 -47.42 80.73 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.354 -0.384 . . . . 10.0 111.159 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -46.52 70.4 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 120.78 0.324 . . . . 10.0 111.532 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.601 HD13 ' CG1' ' D' ' 388' ' ' VAL . 23.9 mt -61.1 -42.25 92.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.564 -0.289 . . . . 10.0 111.618 -179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.57 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 23.5 tp60 -66.81 -26.49 66.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.258 -0.428 . . . . 10.0 112.068 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.533 HD22 HG12 ' B' ' 152' ' ' VAL . 13.8 tp -94.33 -38.22 11.1 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.246 0.461 . . . . 10.0 112.246 -179.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . 0.416 HD12 ' HB2' ' B' ' 42' ' ' LYS . 43.9 mm -81.17 -66.41 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 111.734 0.272 . . . . 10.0 111.734 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -79.84 -20.05 46.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.795 0.331 . . . . 10.0 111.194 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.57 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 13.9 m-80 71.58 30.06 2.5 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.581 -0.736 . . . . 10.0 111.688 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . 0.454 ' O ' HG22 ' B' ' 21' ' ' ILE . 72.4 t60 -118.65 146.25 44.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.094 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . 0.437 ' HB2' ' OE1' ' B' ' 22' ' ' GLN . 40.5 t80 -113.95 124.33 51.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.03 -0.359 . . . . 10.0 110.03 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 18.4 m -83.42 175.87 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 120.933 0.397 . . . . 10.0 111.483 -179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -132.06 -24.44 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.438 0.637 . . . . 10.0 109.848 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.61 163.98 12.09 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.602 -0.726 . . . . 10.0 111.211 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.412 ' HD1' H5'2 ' B' ' 216' ' ' GNP . 58.7 t80 -107.46 116.92 32.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.494 -0.558 . . . . 10.0 109.494 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -124.32 110.7 28.54 Favored Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.03 116.6 3.15 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 123.238 2.626 . . . . 10.0 112.868 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.18 141.72 32.64 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.7 -0.682 . . . . 10.0 110.901 -179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 54.4 mt -110.65 -54.85 5.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 10.0 110.982 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.784 ' HB2' ' CG2' ' D' ' 369' ' ' VAL . 33.9 mt-10 -136.5 93.36 2.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.524 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 10.5 t0 -109.48 138.99 45.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.129 -0.357 . . . . 10.0 110.319 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 29.6 m -130.38 125.52 34.77 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.487 0.551 . . . . 10.0 112.487 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -126.4 135.46 51.45 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.558 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' B' ' 53' ' ' LEU . 1.4 ttp180 -135.81 107.94 7.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.798 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . 0.416 ' HB2' HD12 ' B' ' 24' ' ' ILE . 17.8 ttpt -113.6 139.51 48.96 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.097 0.406 . . . . 10.0 112.097 -178.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -83.34 93.57 7.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.787 -0.642 . . . . 10.0 109.728 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 27.6 m -106.1 170.18 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.237 0.541 . . . . 10.0 111.899 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.6 t -124.15 100.89 8.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.167 -0.679 . . . . 10.0 109.167 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 62.9 mt -112.72 128.21 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.73 -0.214 . . . . 10.0 110.717 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.56 ' HA ' ' HD2' ' D' ' 448' ' ' LYS . 3.2 m-20 67.7 3.11 3.29 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.925 0.765 . . . . 10.0 112.664 179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.611 ' HA2' ' CB ' ' D' ' 450' ' ' ALA . . . 124.03 -48.94 0.92 Allowed Glycine 0 N--CA 1.441 -0.986 0 C-N-CA 120.348 -0.929 . . . . 10.0 112.28 179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 49' ' ' GLU . 9.2 pt-20 -80.51 166.8 20.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.947 0.403 . . . . 10.0 111.504 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 1.3 m -82.45 127.06 32.92 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . 0.404 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 84.8 m -112.54 137.71 50.37 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.28 0.562 . . . . 10.0 111.265 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.697 HD22 ' HG3' ' B' ' 3' ' ' GLU . 7.2 tt -99.64 109.39 21.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.407 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.542 ' O ' ' HA ' ' B' ' 41' ' ' ARG . 68.6 mt -95.72 100.46 12.18 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.336 -0.393 . . . . 10.0 111.183 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.29 90.89 5.62 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.178 -1.045 . . . . 10.0 108.178 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 28.5 mt -91.74 128.91 43.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.575 -0.739 . . . . 10.0 111.318 -178.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 tp -111.63 108.7 18.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.747 -0.66 . . . . 10.0 109.805 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.799 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 25.5 t0 -88.96 114.71 25.88 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 75.3 p -92.98 -163.68 1.08 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.51 0.559 . . . . 10.0 112.51 -178.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -106.45 151.1 25.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 10.0 110.814 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -111.61 7.12 28.07 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.39 -0.684 . . . . 10.0 111.39 179.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -111.08 10.65 22.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.985 0.421 . . . . 10.0 110.667 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.49 154.08 20.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.412 -179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -103.82 -66.54 0.94 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.332 -0.849 . . . . 10.0 109.44 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -150.78 120.9 7.21 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.028 -0.533 . . . . 10.0 109.636 179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -128.86 135.63 49.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.151 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.5 -41.23 93.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.837 0.351 . . . . 10.0 111.527 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 76.9 mmm -67.48 -29.07 68.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.359 . . . . 10.0 110.767 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.465 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 14.7 ttm180 -64.29 -33.6 76.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.349 0.595 . . . . 10.0 109.945 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -75.73 3.81 9.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.285 -0.871 . . . . 10.0 110.343 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.92 -60.29 1.91 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.406 -0.361 . . . . 10.0 111.69 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.465 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 3.1 p90 -65.06 -27.23 68.64 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.712 1.005 . . . . 10.0 113.712 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.463 ' HG3' HG11 ' B' ' 7' ' ' VAL . 32.7 ttp -76.05 -16.48 59.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.499 . . . . 10.0 110.721 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -81.22 -22.93 38.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.279 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 4.5 m -75.17 -20.02 59.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.399 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.23 141.75 36.25 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.744 -0.662 . . . . 10.0 112.659 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -101.3 -29.55 12.0 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.567 -0.531 . . . . 10.0 109.567 179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -128.43 147.78 17.6 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 111.163 -0.775 . . . . 10.0 111.163 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.622 ' HB2' ' HG2' ' B' ' 111' ' ' MET . 56.5 m-85 -133.23 140.73 47.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.881 0.372 . . . . 10.0 110.762 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.548 ' HG ' HD22 ' B' ' 159' ' ' LEU . 59.2 mt -116.59 111.23 19.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.074 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.412 ' HB2' HD12 ' B' ' 113' ' ' LEU . 14.1 m -77.71 80.43 4.17 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.829 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 31.5 m -81.99 135.88 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.808 -0.633 . . . . 10.0 112.151 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.779 ' HB3' HD11 ' B' ' 93' ' ' ILE . 31.3 p90 -155.04 158.79 39.64 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.186 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.543 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.04 122.4 39.99 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.994 HD11 ' HA ' ' B' ' 118' ' ' CYS . 23.8 pt -73.08 -0.19 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 112.589 0.589 . . . . 10.0 112.589 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.543 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 7.5 p-10 -94.12 1.07 56.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.152 0.501 . . . . 10.0 110.292 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.489 HD21 ' HB3' ' B' ' 88' ' ' LYS . 56.9 t30 -135.16 120.96 19.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.61 -0.723 . . . . 10.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 3.8 m -66.51 -34.45 77.94 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.109 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.489 ' HB3' HD21 ' B' ' 86' ' ' ASN . 19.4 tptp -54.98 -51.78 65.11 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.553 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -57.67 -33.63 68.54 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.938 0.718 . . . . 10.0 112.938 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -68.61 -33.54 74.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.195 0.521 . . . . 10.0 110.673 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -83.13 -24.75 32.45 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.09 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -72.52 -18.51 61.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.164 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.779 HD11 ' HB3' ' B' ' 82' ' ' PHE . 34.5 mm -55.53 -46.72 79.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.212 -0.449 . . . . 10.0 111.48 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -62.37 -37.64 86.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.274 -0.421 . . . . 10.0 111.245 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -58.97 -50.08 75.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.314 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -70.54 -29.65 66.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.197 -0.456 . . . . 10.0 111.157 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.23 -49.03 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.132 0.491 . . . . 10.0 109.844 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -67.26 -30.66 70.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.706 -0.679 . . . . 10.0 110.827 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.41 -49.25 72.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.976 -0.556 . . . . 10.0 109.692 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.54 -45.13 97.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.367 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' B' ' 101' ' ' LYS . 39.4 mtpt -55.61 -43.02 75.71 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.54 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 59.1 ttp85 -68.47 -44.63 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.881 -0.599 . . . . 10.0 111.675 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.86 -41.41 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 120.988 0.423 . . . . 10.0 111.466 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -80.65 -14.19 58.38 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.214 -0.448 . . . . 10.0 111.016 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 21.9 t70 59.86 37.41 21.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.401 0.62 . . . . 10.0 110.191 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 4.4 m -142.87 132.21 23.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.629 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -72.62 -33.26 66.54 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.175 0.512 . . . . 10.0 110.658 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -113.06 114.63 27.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.423 -0.808 . . . . 10.0 111.192 -178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.68 157.52 69.85 Favored Pre-proline 0 C--O 1.239 0.533 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.407 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.48 106.95 2.05 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.058 2.506 . . . . 10.0 112.133 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.622 ' HG2' ' HB2' ' B' ' 78' ' ' PHE . 63.3 mtm -137.04 146.22 44.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.321 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.439 ' HB ' HD23 ' B' ' 79' ' ' LEU . 95.1 t -131.28 136.29 57.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 109.562 -0.533 . . . . 10.0 109.562 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.597 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 13.8 tp -84.31 119.14 24.72 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.404 -0.591 . . . . 10.0 109.404 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 96.2 t -115.77 109.58 28.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.06 0.457 . . . . 10.0 111.983 -178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -97.07 105.59 3.22 Favored Glycine 0 N--CA 1.446 -0.67 0 N-CA-C 110.434 -1.067 . . . . 10.0 110.434 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' B' ' 144' ' ' THR . 67.1 t30 -89.11 165.67 14.35 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 120.558 0.218 . . . . 10.0 111.519 -178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.442 ' HD2' ' OD1' ' B' ' 85' ' ' ASN . 89.2 mttt 64.62 39.32 6.63 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.863 -0.608 . . . . 10.0 111.574 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.994 ' HA ' HD11 ' B' ' 84' ' ' ILE . 5.0 p -79.12 -3.02 43.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.598 0.592 . . . . 10.0 112.598 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -106.94 3.02 25.7 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.384 0.612 . . . . 10.0 110.835 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.424 HD12 ' HB3' ' B' ' 117' ' ' LYS . 42.4 mt -93.34 140.0 23.11 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.912 -0.586 . . . . 10.0 110.254 179.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.13 -13.6 40.61 Favored 'Trans proline' 0 N--CA 1.473 0.309 0 C-N-CA 123.191 2.594 . . . . 10.0 112.75 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . 0.408 ' HB2' ' HB2' ' B' ' 85' ' ' ASN . 0.7 OUTLIER -78.65 8.3 5.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.407 -0.361 . . . . 10.0 111.293 -179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.722 ' HG3' HD12 ' B' ' 84' ' ' ILE . 22.5 ttm-85 -57.48 108.52 0.56 Allowed 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.934 0.397 . . . . 10.0 111.008 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -102.34 -36.29 8.51 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.173 0.511 . . . . 10.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 63.7 t -78.92 123.37 35.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.888 -0.596 . . . . 10.0 110.603 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.3 144.7 34.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.53 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.486 HG23 ' HE2' ' B' ' 141' ' ' PHE . 3.2 m -60.62 -39.81 89.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.01 -0.541 . . . . 10.0 112.205 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -63.48 -35.16 79.54 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.496 0.184 . . . . 10.0 111.496 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -62.13 -46.6 88.3 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.187 0.517 . . . . 10.0 110.172 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.78 -40.75 83.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.567 -0.742 . . . . 10.0 110.854 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -60.29 -52.78 63.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.656 -0.702 . . . . 10.0 111.585 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -60.02 -44.47 94.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.226 -0.443 . . . . 10.0 111.309 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 15.5 tp -60.03 -52.81 63.8 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.943 -0.571 . . . . 10.0 111.106 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.01 -37.03 85.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.221 -0.445 . . . . 10.0 111.521 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -64.85 -27.15 68.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 10.0 111.343 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -31.29 57.28 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.204 -0.453 . . . . 10.0 111.027 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.61 -35.14 21.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.32 -0.4 . . . . 10.0 111.39 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 105.85 34.59 3.21 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.049 -0.596 . . . . 10.0 112.112 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' B' ' 140' ' ' PRO . 25.1 pt -127.73 145.47 55.06 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 139' ' ' ILE . 3.9 Cg_exo -77.63 152.48 29.5 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.751 2.3 . . . . 10.0 112.563 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . 0.486 ' HE2' HG23 ' B' ' 127' ' ' THR . 46.7 t80 -123.55 131.97 53.77 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.813 -0.63 . . . . 10.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 17.5 mm -132.18 130.86 60.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.276 -0.42 . . . . 10.0 110.084 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -85.47 119.25 25.61 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.773 -0.825 . . . . 10.0 108.773 177.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 5.6 m -117.16 154.04 31.78 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.127 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 13.5 t -136.9 113.39 10.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.09 -31.61 56.06 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.48 ' HB2' ' N1 ' ' B' ' 216' ' ' GNP . 28.2 tttm -61.51 -36.02 79.34 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.27 -0.877 . . . . 10.0 112.146 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.07 -3.85 13.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.563 0.579 . . . . 10.0 112.563 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.511 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 0.1 OUTLIER 58.38 49.88 10.26 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.43 0.633 . . . . 10.0 111.205 -178.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -120.44 132.1 55.07 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.566 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 77.46 1.86 77.75 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.097 -0.573 . . . . 10.0 112.715 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . 0.533 HG12 HD22 ' B' ' 23' ' ' LEU . 3.0 t -73.44 -48.82 40.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 120.863 0.363 . . . . 10.0 110.079 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.77 -60.57 3.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.335 -0.848 . . . . 10.0 111.283 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -55.44 -47.31 76.21 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 113.08 0.77 . . . . 10.0 113.08 -178.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -54.88 -45.95 74.69 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.857 0.318 . . . . 10.0 111.857 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -65.51 -42.39 92.15 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.734 0.302 . . . . 10.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.426 ' O ' ' HG3' ' B' ' 161' ' ' ARG . 7.7 m-85 -69.15 -32.18 71.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.565 -0.288 . . . . 10.0 111.544 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 96.7 m -57.07 -42.6 80.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.107 0.48 . . . . 10.0 110.471 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.602 HD23 HD22 ' B' ' 6' ' ' LEU . 30.8 tp -60.58 -42.37 96.54 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.892 -0.595 . . . . 10.0 111.084 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 43.2 t -61.24 -40.63 86.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.662 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . 0.441 HH11 ' HD2' ' B' ' 161' ' ' ARG . 37.2 mtt180 -64.64 -45.33 87.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.165 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -61.77 -37.87 85.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.467 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 92.0 mt -62.31 -42.06 93.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.701 0.286 . . . . 10.0 110.44 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' B' ' 164' ' ' ARG . 34.4 mtt180 -63.82 -41.79 97.79 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.637 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -66.06 -38.48 88.44 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . 0.435 ' O ' ' HG2' ' B' ' 170' ' ' MET . 1.0 OUTLIER -64.85 -43.76 91.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.231 -0.895 . . . . 10.0 111.305 179.425 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 56.4 tttm -61.69 -44.9 96.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.641 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -66.29 -39.84 89.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.813 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -59.27 -31.68 69.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.251 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 166' ' ' HIS . 22.4 mmt -62.3 -34.31 76.34 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.111 0.411 . . . . 10.0 112.111 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 50.0 m -77.48 -29.49 52.65 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.173 0.434 . . . . 10.0 112.173 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.456 ' HE3' ' HB2' ' B' ' 172' ' ' LYS . 34.7 mtmt -93.25 -41.85 9.66 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.878 0.696 . . . . 10.0 112.878 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -78.57 -55.75 4.96 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.286 -0.415 . . . . 10.0 111.352 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 95.97 27.46 10.24 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.841 -0.695 . . . . 10.0 112.225 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm 62.78 48.81 3.97 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 111.934 0.346 . . . . 10.0 111.934 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 176' ' ' LYS . 12.7 mmmm -88.4 -49.64 6.81 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.888 -0.325 . . . . 10.0 110.719 -179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? 56.61 62.2 2.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.86 -0.609 . . . . 10.0 111.44 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 36.3 tttm -79.85 62.89 4.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.198 0.523 . . . . 10.0 110.745 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -97.74 -35.93 10.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 10.0 110.844 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -69.77 -42.21 74.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.047 0.451 . . . . 10.0 110.707 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.01 110.38 18.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.246 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' B' ' 182' ' ' LYS . 1.2 mmmp? -92.83 12.76 22.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.378 -179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.28 136.18 54.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.806 -0.634 . . . . 10.0 110.431 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.459 ' HB3' H172 ' B' ' 201' ' ' PCW . 49.9 mtmt -60.17 122.45 14.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 10.0 110.773 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.544 ' HB2' H131 ' B' ' 201' ' ' PCW . 3.8 m . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.059 -0.519 . . . . 10.0 111.181 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . 0.474 ' HA ' HD12 ' D' ' 422' ' ' ILE . 63.8 t30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.909 0.385 . . . . 10.0 110.893 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . 0.461 ' H ' HG13 ' D' ' 422' ' ' ILE . 2.3 m -143.71 125.45 15.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.404 -0.362 . . . . 10.0 110.513 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 6.0 tp -120.4 119.42 59.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.014 0.435 . . . . 10.0 110.072 178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -89.73 105.49 17.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.094 0.473 . . . . 10.0 111.863 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 38.2 t -97.28 118.37 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.871 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -105.05 133.01 50.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.513 179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.827 ' HB2' ' HB3' ' D' ' 366' ' ' GLN . 5.9 mp -101.46 170.59 6.3 Favored Pre-proline 0 C--N 1.316 -0.862 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.641 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.712 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.2 Cg_endo -55.17 157.22 14.35 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.685 2.257 . . . . 10.0 112.497 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 65.3 t30 71.26 -100.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 10.0 111.821 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -148.81 42.23 0.96 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.421 0.629 . . . . 10.0 110.706 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.827 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 0.2 OUTLIER -105.16 138.23 41.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.148 -179.333 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' D' ' 367' ' ' ARG . 6.2 ptt85 -136.97 131.16 32.58 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.709 0.29 . . . . 10.0 110.938 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 49.1 m -138.25 98.54 3.64 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.363 0.601 . . . . 10.0 110.514 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.784 ' CG2' ' HB2' ' B' ' 37' ' ' GLU . 21.9 t -87.86 125.13 41.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.068 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 4.2 m -118.34 167.93 11.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.748 0.308 . . . . 10.0 110.659 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -112.48 92.05 3.88 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.07 0.462 . . . . 10.0 110.865 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 27.2 m -85.83 164.19 2.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.588 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 7.5 tpp85 -154.45 157.06 37.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.38 -0.6 . . . . 10.0 109.38 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 68.05 -162.52 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.716 0.635 . . . . 10.0 111.031 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -78.66 100.88 1.74 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.64 -0.79 . . . . 10.0 112.107 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 42.3 mtt -131.1 126.43 35.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.767 0.318 . . . . 10.0 111.146 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.87 168.71 11.24 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 109.964 179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' D' ' 416' ' ' THR . 79.3 mt -56.3 -47.1 79.33 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.827 0.306 . . . . 10.0 111.827 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . 0.642 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 14.9 t-80 -60.42 -43.39 96.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.469 -0.332 . . . . 10.0 111.534 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -58.97 -44.53 91.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.186 -0.461 . . . . 10.0 111.211 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 8.8 m -73.25 -36.57 66.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.39 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 38.9 mt -68.98 -30.29 68.68 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.329 0.492 . . . . 10.0 112.329 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 38.1 ttp -58.53 -33.48 69.92 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.751 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -61.88 -46.45 89.36 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.667 -0.697 . . . . 10.0 111.188 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -78.56 -27.55 45.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.991 -0.549 . . . . 10.0 111.222 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.01 -47.46 80.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.172 -0.467 . . . . 10.0 111.814 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 17.4 ptmt -72.23 -18.94 61.79 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.145 -0.479 . . . . 10.0 111.715 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.601 ' CG1' HD13 ' B' ' 21' ' ' ILE . 45.5 t -84.58 -40.87 15.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.057 0.456 . . . . 10.0 110.666 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' D' ' 389' ' ' ARG . 5.2 mmt180 -83.47 -21.07 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.184 -0.462 . . . . 10.0 111.473 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 64.49 53.52 35.0 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.024 -0.608 . . . . 10.0 112.981 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . 0.508 HD13 ' HZ ' ' D' ' 430' ' ' PHE . 96.0 mt -122.13 -169.53 1.9 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.803 0.335 . . . . 10.0 110.923 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -119.95 127.53 26.33 Favored Pre-proline 0 C--O 1.235 0.31 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.07 -16.18 20.18 Favored 'Trans proline' 0 CA--C 1.527 0.144 0 C-N-CA 122.781 2.321 . . . . 10.0 111.864 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -62.74 -42.49 99.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.919 -0.582 . . . . 10.0 111.122 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 35.0 m -87.91 -0.23 56.72 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.251 -0.432 . . . . 10.0 112.07 -179.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 85.7 m -102.32 151.32 22.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.996 0.427 . . . . 10.0 111.986 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . 0.586 ' HB2' HD22 ' D' ' 431' ' ' LEU . . . -135.41 151.75 50.74 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.063 -0.717 . . . . 10.0 109.063 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' D' ' 411' ' ' ARG . 2.5 m -96.17 115.86 36.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.812 0.339 . . . . 10.0 111.588 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.497 ' CE2' ' HB3' ' D' ' 429' ' ' ASP . 78.2 m-85 -115.45 128.4 56.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.138 -0.483 . . . . 10.0 110.445 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -84.6 170.75 13.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.465 -0.334 . . . . 10.0 111.271 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' D' ' 425' ' ' GLU . 36.4 tp -62.47 145.85 53.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.735 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 2.9 mp -60.81 110.79 1.41 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.462 -0.336 . . . . 10.0 111.21 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -114.18 100.92 8.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.175 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 53.81 51.4 14.96 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.029 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.527 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 4.1 t-80 -118.39 160.6 21.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.235 -0.439 . . . . 10.0 110.499 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -68.75 -37.06 79.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.118 0.485 . . . . 10.0 109.992 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 153.31 52.97 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.73 -0.668 . . . . 10.0 111.722 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.527 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 22.0 ttpp -144.37 146.03 32.3 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.65 -0.5 . . . . 10.0 109.65 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.439 ' HB2' ' HB3' ' D' ' 399' ' ' PHE . 18.6 pttt -73.84 149.43 41.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.822 0.344 . . . . 10.0 111.021 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -112.51 117.2 31.71 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.367 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . 0.445 ' HD3' ' HB1' ' D' ' 397' ' ' ALA . 18.0 ttp180 -81.2 136.74 35.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.19 -0.459 . . . . 10.0 111.847 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 10.8 mt -117.51 -157.32 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.659 -0.7 . . . . 10.0 109.688 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -108.15 159.26 16.73 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.347 -0.612 . . . . 10.0 109.347 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . 0.642 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 32.0 m95 -80.15 -21.72 42.8 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.741 0.305 . . . . 10.0 111.211 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -86.11 -0.59 55.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.865 0.364 . . . . 10.0 111.411 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.504 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 35.7 m -61.45 136.12 57.92 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 10.0 110.243 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.88 137.13 53.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.005 -0.543 . . . . 10.0 111.694 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -84.26 -27.2 28.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 10.0 111.489 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.38 -29.96 70.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.101 0.476 . . . . 10.0 110.896 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 15.2 m -80.81 -2.48 47.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.827 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 7.0 mp -117.09 26.51 9.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 10.0 111.218 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . 0.474 HD12 ' HA ' ' D' ' 356' ' ' ASN . 5.7 tt -59.16 123.12 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.292 0.568 . . . . 10.0 111.669 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 96.34 -21.39 45.69 Favored Glycine 0 N--CA 1.443 -0.868 0 C-N-CA 120.774 -0.727 . . . . 10.0 112.93 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -77.88 158.5 29.4 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.149 0.499 . . . . 10.0 111.906 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.525 ' HB2' HD13 ' D' ' 401' ' ' LEU . 37.8 mt-10 -110.61 101.89 10.51 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.665 -0.698 . . . . 10.0 110.719 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.49 HD22 HD22 ' D' ' 378' ' ' LEU . 7.0 tp -92.34 131.14 37.77 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.063 -0.517 . . . . 10.0 109.994 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -113.96 132.32 56.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.107 0.479 . . . . 10.0 111.033 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.4 t -104.81 88.57 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.025 -0.534 . . . . 10.0 109.832 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . 0.497 ' HB3' ' CE2' ' D' ' 399' ' ' PHE . 34.7 t70 -96.52 161.02 14.09 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.944 -0.571 . . . . 10.0 111.139 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . 0.52 ' HE2' ' HG3' ' D' ' 363' ' ' PRO . 77.4 m-85 -87.39 121.49 29.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.196 -0.457 . . . . 10.0 110.401 -179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . 0.586 HD22 ' HB2' ' D' ' 397' ' ' ALA . 0.9 OUTLIER -88.86 -35.2 16.69 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.067 0.46 . . . . 10.0 111.07 -179.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -144.01 94.82 2.63 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.153 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -150.84 159.11 44.76 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.098 -0.501 . . . . 10.0 109.817 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 15.1 t -74.76 115.0 39.92 Favored Pre-proline 0 C--N 1.326 -0.433 0 O-C-N 123.36 0.413 . . . . 10.0 110.271 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.74 -174.42 2.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.522 2.148 . . . . 10.0 111.963 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' D' ' 436' ' ' LEU . 4.1 mm? 70.0 110.76 0.05 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.477 0.656 . . . . 10.0 112.209 179.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -95.35 113.4 25.06 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.66 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -174.54 5.08 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 112.542 0.571 . . . . 10.0 112.542 -179.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 484' ' ' CYS . 44.3 t60 -90.34 122.65 33.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.198 -0.91 . . . . 10.0 110.551 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -99.57 135.88 40.33 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.619 -0.512 . . . . 10.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -88.11 120.36 29.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.144 0.497 . . . . 10.0 112.259 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' D' ' 464' ' ' ARG . . . -134.79 105.5 6.47 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.626 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -96.74 87.34 4.3 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.882 -0.599 . . . . 10.0 111.232 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.48 163.87 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.232 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.9 146.2 47.51 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.407 0.442 . . . . 10.0 110.475 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . 0.447 ' CZ ' HD12 ' D' ' 459' ' ' LEU . 7.3 m-85 -78.77 159.98 27.64 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.033 -0.53 . . . . 10.0 111.244 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 3.0 mt -81.28 -22.87 38.31 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.56 -178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . 0.56 ' HD2' ' HA ' ' B' ' 47' ' ' ASP . 4.4 tmtt? -173.18 154.71 2.79 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.473 -0.936 . . . . 10.0 108.473 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 39.3 tp -49.65 112.27 0.63 Allowed 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.737 0.648 . . . . 10.0 112.284 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . 0.611 ' CB ' ' HA2' ' B' ' 48' ' ' GLY . . . -111.2 176.16 5.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.268 -0.878 . . . . 10.0 109.243 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -123.36 153.82 39.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.0 -0.371 . . . . 10.0 110.0 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.503 ' CA ' HD23 ' D' ' 459' ' ' LEU . 7.9 t -76.32 134.31 39.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.212 0.529 . . . . 10.0 110.686 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.45 -14.86 36.91 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.709 -0.849 . . . . 10.0 108.709 178.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . 0.485 HD11 ' HE2' ' D' ' 470' ' ' TYR . 19.4 mm -92.57 -52.58 9.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.331 -0.85 . . . . 10.0 110.07 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 3.8 m -91.45 -166.24 1.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.408 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -120.98 22.11 11.15 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.445 0.64 . . . . 10.0 109.79 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -116.46 178.24 4.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.71 -0.677 . . . . 10.0 111.154 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 7.7 p90 -75.83 158.11 32.55 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.954 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.503 HD23 ' CA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -104.98 125.59 51.13 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.362 -0.381 . . . . 10.0 110.371 -179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.59 -160.94 0.74 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.553 -0.749 . . . . 10.0 109.254 179.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -67.37 81.33 0.15 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.359 0.599 . . . . 10.0 111.887 179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -116.63 -111.87 2.69 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.812 -0.631 . . . . 10.0 112.099 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -123.33 140.48 52.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.86 0.362 . . . . 10.0 111.289 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' D' ' 442' ' ' ALA . 10.1 ptm180 -153.39 117.51 4.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.169 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -78.1 157.59 29.44 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.543 0.942 . . . . 10.0 113.543 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -99.45 -32.63 11.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.091 -0.959 . . . . 10.0 108.588 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 2.6 p -74.67 -32.12 62.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.123 -0.944 . . . . 10.0 110.064 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -116.89 -72.46 0.69 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.276 -0.875 . . . . 10.0 110.656 -179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 110.1 39.33 1.55 Allowed Glycine 0 N--CA 1.453 -0.177 0 C-N-CA 120.394 -0.908 . . . . 10.0 112.312 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . 0.485 ' HE2' HD11 ' D' ' 454' ' ' ILE . 1.0 OUTLIER -82.17 149.6 27.84 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.859 0.361 . . . . 10.0 110.126 179.913 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.4 ' H ' ' HG2' ' D' ' 471' ' ' LYS . 16.4 pttt -114.17 109.11 17.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.216 -179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.903 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 28.3 p90 -150.87 163.43 38.67 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -90.5 -177.0 4.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.374 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.75 -32.04 73.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -79.79 -27.02 40.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.422 . . . . 10.0 110.559 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 5.2 m -74.12 -28.08 61.17 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 10.0 111.799 -179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.05 -51.63 17.05 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.633 0.605 . . . . 10.0 112.633 -179.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.8 19.67 17.79 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.871 -0.604 . . . . 10.0 110.886 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.563 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 45.1 tttm -111.39 -39.06 4.79 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.411 -0.358 . . . . 10.0 110.934 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.441 HG12 ' O ' ' D' ' 476' ' ' CYS . 7.5 p -73.16 118.79 71.58 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 10.0 111.424 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -81.05 -19.65 8.02 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.553 2.169 . . . . 10.0 111.767 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 7.4 m -78.93 98.59 6.46 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.117 0.484 . . . . 10.0 110.316 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 37.5 tpp -70.1 147.7 49.65 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.724 -0.671 . . . . 10.0 109.582 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.611 ' HB2' ' HB2' ' D' ' 439' ' ' HIS . 79.4 m -70.42 78.95 0.55 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.1 0.476 . . . . 10.0 111.711 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.41 96.75 4.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.248 -0.649 . . . . 10.0 109.248 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -112.27 128.95 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.188 -0.46 . . . . 10.0 111.35 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 21.6 p90 . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.314 -0.403 . . . . 10.0 110.776 178.976 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.08 ' H39' H271 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 1.021 H281 H221 ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.065 ' H41' ' H40' ' A' ' 406' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.035 H152 H211 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.247 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 1.065 ' H40' ' H41' ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.098 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.048 H121 ' H33' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.048 ' H33' H121 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.654 ' H76' H452 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.021 H451 H242 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 0.98 ' H12' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.021 H221 H281 ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 1.06 H281 H271 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.007 ' H11' H411 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.023 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.051 H241 ' H20' ' A' ' 417' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 1.002 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.076 H142 H381 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.136 H222 H351 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.072 ' O4P' ' H31' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.021 H472 H432 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.114 ' H73' ' H19' ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.043 ' H41' H222 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.079 H251 ' H70' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 0.773 ' C20' H241 ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.037 ' H19' H371 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.022 H332 H132 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.014 H212 ' H51' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 0.99 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.093 ' H42' ' H2 ' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 0.89 ' P ' ' H31' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.035 H471 H431 ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 0.948 H381 H161 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.021 H432 H472 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 0.986 ' H20' H10A ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.107 ' H32' ' O1P' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.113 H341 H442 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.089 H322 ' C36' ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.058 H462 H431 ' A' ' 414' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.114 ' H19' ' H73' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.061 H241 H451 ' D' ' 516' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.079 ' H70' H251 ' C' ' 608' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.12 ' C7 ' H18A ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 1.089 ' H33' H141 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 1.039 ' H70' ' H36' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.023 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 0.832 ' H51' H281 ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 0.986 H10A ' H20' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.005 H162 H211 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.176 H362 ' C31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.179 H212 ' C32' ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.059 ' C19' H231 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 0.883 ' H52' ' H9 ' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.08 ' H31' ' O1P' ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 0.826 H322 ' H51' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.179 ' C32' H212 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 1.017 H262 H482 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.035 H211 H152 ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.058 H261 H221 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.061 H272 ' H61' ' D' ' 512' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.027 H20A H142 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 0.93 ' H2 ' ' H42' ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.054 ' H35' ' H78' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.48 ' N1 ' ' HB2' ' B' ' 147' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.031 ' H62' ' H2 ' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.08 H271 ' H39' ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 0.979 H332 ' H82' ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.031 H262 H222 ' D' ' 504' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.114 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.13 ' H32' ' O1P' ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 0.963 H242 H482 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.073 ' H41' ' H31' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.031 ' H2 ' ' H62' ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.004 H471 H152 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.014 ' H51' H212 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.061 ' H61' H272 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.054 ' H38' H431 ' D' ' 506' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 0.986 ' H43' H242 ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.136 H351 H222 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.113 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.234 0.238 0 CA-C-O 121.319 0.581 . . . . 10.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -60.37 -42.19 95.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.278 -0.873 . . . . 10.0 110.762 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 203' ' ' LEU . 1.2 pt? -61.79 -30.44 70.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.1 -0.5 . . . . 10.0 111.37 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 95.3 mt -70.96 -40.74 71.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.459 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -68.13 -41.52 81.58 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.296 -0.631 . . . . 10.0 109.296 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -63.53 -41.99 98.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 10.0 109.837 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -65.17 -44.7 87.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.013 -0.539 . . . . 10.0 110.222 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -59.68 -35.12 73.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.31 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 16.3 m -61.93 -41.89 98.46 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.225 -0.287 . . . . 10.0 110.225 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 4.6 t -70.55 -35.25 60.7 Favored 'Isoleucine or valine' 0 C--O 1.231 0.128 0 N-CA-C 109.97 -0.382 . . . . 10.0 109.97 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 11.8 m -62.36 -40.81 97.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.054 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 15.5 m -65.34 -30.27 71.09 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.019 0.437 . . . . 10.0 109.946 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . . . . . . . . . 15.7 m -62.29 -42.1 99.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 108.712 -0.848 . . . . 10.0 108.712 178.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -63.59 -37.68 88.26 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.674 -0.694 . . . . 10.0 110.466 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . 0.406 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 3.5 m -60.67 -50.89 71.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.04 -0.527 . . . . 10.0 109.883 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -62.25 -39.9 94.41 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.2 0.524 . . . . 10.0 110.302 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 221' ' ' LEU . 74.0 mt -62.58 -47.4 83.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.628 -0.715 . . . . 10.0 111.043 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -63.27 -32.63 74.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.673 -0.239 . . . . 10.0 111.239 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 215' ' ' SER . 74.3 mt-10 -67.94 -42.18 81.36 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.523 -0.547 . . . . 10.0 109.523 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -72.42 -33.08 66.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.367 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.561 HD21 H212 ' A' ' 402' ' ' PCW . 33.6 mt -56.85 -28.44 61.68 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.872 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -57.85 -70.88 0.85 Allowed Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.974 -0.85 . . . . 10.0 110.974 178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -53.65 -37.73 83.82 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.626 2.217 . . . . 10.0 110.898 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 37.2 t -56.68 -51.44 66.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.146 0 CA-C-N 116.373 -0.376 . . . . 10.0 110.83 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . 0.546 ' O ' ' HB2' ' A' ' 229' ' ' TRP . 3.5 p -68.35 -34.94 77.0 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 121.008 -0.277 . . . . 10.0 110.642 179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -62.39 -53.54 53.52 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.409 -0.36 . . . . 10.0 110.059 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -64.78 -42.0 95.41 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 123.65 0.594 . . . . 10.0 110.905 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . 0.459 ' HD1' ' HA ' ' A' ' 228' ' ' PHE . 0.9 OUTLIER -62.05 -44.87 95.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.603 -0.271 . . . . 10.0 110.293 179.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . 0.594 ' O ' ' HG2' ' A' ' 233' ' ' GLU . 1.1 t-105 -64.59 -41.42 96.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.956 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.85 -43.93 94.38 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.168 0.508 . . . . 10.0 109.827 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.762 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 81.6 m-20 -69.4 -34.15 74.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.059 -0.518 . . . . 10.0 110.009 178.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . 0.516 HD21 H483 ' A' ' 402' ' ' PCW . 40.8 mt -66.27 -34.88 78.99 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.875 -0.602 . . . . 10.0 109.535 178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 229' ' ' TRP . 10.0 mm-40 -63.19 -41.59 99.21 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 177.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.762 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 46.4 mttt -64.58 -40.77 96.15 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.699 -0.682 . . . . 10.0 109.377 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -50.7 61.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.567 -0.742 . . . . 10.0 111.027 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . . . . . . . . . 9.3 p -63.65 -42.11 98.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.522 -0.308 . . . . 10.0 110.71 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -64.86 -38.52 91.26 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 10.0 109.787 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -63.6 -45.12 95.39 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.09 -1.204 . . . . 10.0 110.09 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . . . . . . . . . 96.9 mt -67.04 -26.48 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.47 -0.365 . . . . 10.0 110.779 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . . . . . . . . . 54.3 mtt180 -72.79 -39.99 66.25 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.457 -0.572 . . . . 10.0 109.457 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -69.66 -34.58 74.19 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.549 -0.908 . . . . 10.0 108.549 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -72.18 -26.65 62.15 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.176 -0.92 . . . . 10.0 109.454 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.649 ' HG3' HD12 ' A' ' 247' ' ' LEU . 42.0 ttm -60.58 -30.7 69.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.057 0.456 . . . . 10.0 110.014 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 1.2 m -73.09 4.9 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.533 -0.758 . . . . 10.0 110.707 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 30.1 mttm -132.51 -58.43 0.93 Allowed 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.838 -0.801 . . . . 10.0 108.838 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.565 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 5.4 t0 -57.96 -43.39 86.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.418 -0.81 . . . . 10.0 112.11 -179.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.649 HD12 ' HG3' ' A' ' 243' ' ' MET . 29.4 mt -100.8 -12.94 18.65 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.316 0.487 . . . . 10.0 112.316 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -87.33 -52.84 5.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.758 0.313 . . . . 10.0 110.702 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -66.41 -27.54 67.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 10.0 110.637 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.706 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 2.0 p -70.07 -21.21 23.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.109 0.48 . . . . 10.0 110.387 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . 0.452 ' O ' HG12 ' A' ' 254' ' ' VAL . 14.7 tttp -96.63 -40.72 8.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.686 -0.688 . . . . 10.0 109.616 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -66.57 -41.16 88.99 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.384 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -88.23 -7.76 56.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.098 -0.501 . . . . 10.0 111.466 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.706 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.3 OUTLIER -66.63 -30.34 49.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 C-N-CA 120.681 -0.408 . . . . 10.0 110.407 179.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.465 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 11.2 mt-30 -63.67 -60.42 9.21 Favored Pre-proline 0 N--CA 1.451 -0.381 0 CA-C-N 116.124 -0.489 . . . . 10.0 110.839 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 28.6 Cg_endo -63.87 -29.88 67.71 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 121.493 1.462 . . . . 10.0 112.077 179.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 -69.48 -50.64 43.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.716 0.294 . . . . 10.0 110.584 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 47.4 mt -67.79 -45.34 75.08 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.554 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -56.61 -43.13 79.85 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.403 0.44 . . . . 10.0 111.279 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -59.69 -55.19 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.089 -0.505 . . . . 10.0 110.579 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -66.98 -37.28 83.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.068 -0.515 . . . . 10.0 111.633 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . 0.407 ' HG2' ' NE2' ' A' ' 266' ' ' GLN . 50.3 tt0 -63.58 -47.88 79.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.92 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 26.7 ttmt -62.49 -43.06 99.73 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.026 -0.361 . . . . 10.0 110.026 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.427 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 83.4 mttt -65.36 -39.82 92.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.18 179.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.73 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.977 0.418 . . . . 10.0 109.93 178.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 262' ' ' GLN . 38.5 mt-30 -61.6 -44.38 97.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 271' ' ' LEU . 47.9 mt-10 -65.43 -39.7 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.561 -0.745 . . . . 10.0 109.742 178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.26 -41.17 98.22 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.064 -0.516 . . . . 10.0 109.679 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . . . . . . . . . 67.2 mmm -66.92 -40.3 87.62 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.639 -0.709 . . . . 10.0 109.89 178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -60.63 -50.1 74.87 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.221 0.534 . . . . 10.0 109.589 178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 267' ' ' GLU . 83.0 mt -63.77 -37.6 87.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.545 -0.752 . . . . 10.0 110.18 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.78 -33.98 73.13 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.804 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.545 ' HA ' HG12 ' A' ' 276' ' ' VAL . 46.3 mtt180 -73.33 -40.63 64.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.86 0.362 . . . . 10.0 110.356 178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -74.09 -7.72 53.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.085 0.469 . . . . 10.0 110.731 179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.667 ' O ' ' HG ' ' A' ' 279' ' ' LEU . 7.4 mptt -105.78 -43.88 4.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.133 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 273' ' ' ARG . 9.9 p -54.95 -37.37 41.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.142 0.423 . . . . 10.0 112.142 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.517 ' HG3' ' O ' ' A' ' 273' ' ' ARG . 31.8 mt-10 -63.63 -60.67 8.63 Favored Pre-proline 0 CA--C 1.538 0.489 0 N-CA-C 112.146 0.424 . . . . 10.0 112.146 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 282' ' ' GLU . 21.8 Cg_endo -63.89 -36.49 49.86 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 121.635 1.557 . . . . 10.0 111.901 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.667 ' HG ' ' O ' ' A' ' 275' ' ' LYS . 46.1 mt -63.9 -43.92 94.53 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 110.191 -0.3 . . . . 10.0 110.191 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.491 ' HA ' HD12 ' A' ' 283' ' ' LEU . 26.4 ttm180 -63.68 -33.58 75.94 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.513 -0.551 . . . . 10.0 109.513 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . 0.547 ' O ' ' HG3' ' A' ' 285' ' ' GLU . . . -66.78 -47.23 72.79 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.094 -0.706 . . . . 10.0 109.094 178.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 278' ' ' PRO . 89.3 mt-10 -59.58 -43.09 93.77 Favored 'General case' 0 N--CA 1.463 0.198 0 N-CA-C 109.283 -0.636 . . . . 10.0 109.283 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' A' ' 280' ' ' ARG . 62.4 mt -60.51 -40.76 92.58 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.573 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -66.36 -44.73 82.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 10.0 109.913 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' A' ' 281' ' ' ALA . 43.1 mt-10 -58.93 -48.74 80.4 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.518 -0.549 . . . . 10.0 109.518 179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.79 94.4 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 115.537 -0.756 . . . . 10.0 111.584 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -60.23 -45.51 92.98 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 110.299 -0.26 . . . . 10.0 110.299 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -56.4 -49.24 75.07 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.271 0.357 . . . . 10.0 110.587 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 12.7 tm0? -64.69 -49.5 70.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.188 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -62.21 -41.58 98.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.488 -0.324 . . . . 10.0 111.325 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 54.7 mt -65.87 -41.14 91.97 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.968 -0.382 . . . . 10.0 109.968 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -43.65 83.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -58.53 -39.13 79.3 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . 0.431 ' O ' ' HG ' ' A' ' 298' ' ' LEU . 82.3 mt -73.6 -43.44 59.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 10.0 110.061 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -57.52 -42.73 83.42 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.996 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -69.91 0.29 6.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 10.0 111.856 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.493 ' O ' ' HB2' ' A' ' 301' ' ' LEU . 25.0 mmtp -120.47 -32.41 4.09 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.4 -0.592 . . . . 10.0 109.4 178.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 85.4 mt -69.23 -26.72 64.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.896 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.502 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 1.3 m -81.87 -65.02 0.25 Allowed Pre-proline 0 CA--C 1.539 0.537 0 N-CA-C 112.041 0.386 . . . . 10.0 112.041 179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 25.8 Cg_endo -61.83 -53.67 2.03 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.998 1.798 . . . . 10.0 112.367 -179.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 297' ' ' LYS . 85.0 mt -69.42 -27.38 65.22 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 120.847 0.356 . . . . 10.0 110.135 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -67.31 -50.85 41.83 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.511 -1.036 . . . . 10.0 110.511 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -65.62 -33.69 76.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.672 -0.492 . . . . 10.0 109.672 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -65.64 -44.79 85.33 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.281 -0.637 . . . . 10.0 109.281 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 2.6 tpt -63.98 -40.73 97.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.182 0.515 . . . . 10.0 109.926 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 306' ' ' ARG . 61.4 mtt180 -69.77 -34.01 73.18 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.968 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . 0.495 ' O ' ' HB2' ' A' ' 310' ' ' ARG . 31.5 t70 -70.84 -37.34 73.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.123 0.487 . . . . 10.0 109.762 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -65.17 -40.27 94.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.539 -0.912 . . . . 10.0 108.539 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -60.53 -31.66 70.74 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.206 -0.906 . . . . 10.0 110.315 178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.495 ' HB2' ' O ' ' A' ' 307' ' ' ASP . 66.6 mtt180 -58.0 -56.02 27.43 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -66.32 -34.98 79.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.013 -0.54 . . . . 10.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m80 -59.68 -51.64 68.94 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.479 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 41.4 t -75.52 -28.27 19.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.927 -0.578 . . . . 10.0 110.272 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -60.38 -51.34 69.9 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.284 -0.636 . . . . 10.0 109.284 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -61.55 -38.12 86.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.657 -0.701 . . . . 10.0 109.745 179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . 0.408 HD21 ' HE3' ' C' ' 462' ' ' LYS . 19.4 mt -63.42 -46.45 86.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.825 -0.625 . . . . 10.0 109.772 179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . . . . . . . . . 25.2 ttm105 -60.62 -46.14 91.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.586 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 8.4 m -64.42 -28.73 69.88 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.898 -0.592 . . . . 10.0 110.914 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 13.3 m80 -79.5 -43.68 22.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.273 0.558 . . . . 10.0 109.69 178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 323' ' ' TYR . 83.1 mt -66.77 -22.49 66.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 10.0 111.745 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.445 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -57.88 -63.6 3.68 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-O 119.659 -0.21 . . . . 10.0 111.381 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 41.0 Cg_endo -70.41 -33.2 14.53 Favored 'Trans proline' 0 C--N 1.354 0.852 0 C-N-CA 121.404 1.403 . . . . 10.0 111.037 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . 0.46 ' HB2' ' HA ' ' A' ' 320' ' ' LEU . 9.1 m-30 -59.07 -47.8 83.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.185 -0.462 . . . . 10.0 111.042 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . . . . . . . . . 42.0 p -59.66 -44.52 93.54 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.857 0.36 . . . . 10.0 111.098 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 329' ' ' GLN . 9.6 t70 -64.42 -44.82 90.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.683 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -64.5 -34.99 79.51 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.923 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.97 -36.98 86.14 Favored 'General case' 0 CA--C 1.522 -0.126 0 N-CA-C 109.007 -0.738 . . . . 10.0 109.007 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -67.88 -39.91 83.62 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.919 -0.771 . . . . 10.0 108.919 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' A' ' 325' ' ' ASP . 76.1 mt-30 -64.61 -40.7 95.97 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 109.375 -0.602 . . . . 10.0 109.375 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . 0.628 HH21 ' HB3' ' C' ' 447' ' ' GLU . 33.8 mtt-85 -62.31 -48.6 79.13 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.741 -0.837 . . . . 10.0 108.741 177.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 49.6 mt -59.04 -42.62 90.7 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.517 -0.765 . . . . 10.0 110.274 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -62.14 -49.92 73.94 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.633 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.33 -42.27 91.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.085 0.469 . . . . 10.0 110.223 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . 0.416 ' HD3' HH11 ' A' ' 334' ' ' ARG . 40.8 mtt180 -65.2 -45.37 85.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.788 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . . . . . . . . . 23.0 mt -58.92 -44.17 91.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.73 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 36.3 mt-10 -63.92 -44.12 93.85 Favored 'General case' 0 C--N 1.332 -0.18 0 O-C-N 123.299 0.374 . . . . 10.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.03 99.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.469 -0.567 . . . . 10.0 109.469 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 94.0 mt -72.93 -17.21 61.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.084 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -77.87 -52.26 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -63.47 -55.18 26.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.665 -0.698 . . . . 10.0 109.676 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 10.5 t-20 -63.11 -40.97 99.18 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.226 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -61.29 -43.29 99.55 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.869 -0.681 . . . . 10.0 111.782 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -65.07 -41.47 97.14 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.919 -0.873 . . . . 10.0 110.919 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.95 96.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.189 0.518 . . . . 10.0 109.719 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 54.3 mtm180 -65.05 -43.76 91.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.375 -0.83 . . . . 10.0 110.18 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.43 -51.79 68.35 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 110.034 -0.358 . . . . 10.0 110.034 179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -57.13 -41.33 78.85 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.883 -0.599 . . . . 10.0 110.084 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.482 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 8.9 mt-10 -66.01 -46.8 76.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.523 -0.762 . . . . 10.0 110.838 179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -61.11 -42.09 97.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.448 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -63.85 -42.57 97.55 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.725 -0.472 . . . . 10.0 109.725 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -64.12 -46.37 84.44 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . . . . . . . . . 12.5 mtmm -61.57 -43.83 98.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.89 -0.595 . . . . 10.0 109.789 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.56 73.29 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 116.202 -0.454 . . . . 10.0 109.997 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 54.9 m -64.69 -46.47 82.24 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.572 -0.529 . . . . 10.0 109.572 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.6 -33.45 75.93 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.863 -0.608 . . . . 10.0 109.855 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 -74.82 -24.65 58.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.707 -0.678 . . . . 10.0 110.046 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.3 mt -75.64 -41.59 53.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.2 -0.454 . . . . 10.0 110.791 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.64 -42.76 95.23 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 110.001 -0.37 . . . . 10.0 110.001 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.3 p -68.62 -33.91 74.85 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.632 -0.507 . . . . 10.0 109.632 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 363' ' ' LYS . 58.3 tp -66.07 -35.85 81.64 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.845 -0.616 . . . . 10.0 109.343 177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 42.3 m -63.74 -31.51 72.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.911 -0.586 . . . . 10.0 110.319 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.462 ' HG3' ' HE3' ' C' ' 414' ' ' LYS . 7.1 mm-40 -70.5 -18.31 62.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.5 0.667 . . . . 10.0 109.817 179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.683 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 81.9 mttt -94.36 -44.79 7.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.435 -0.802 . . . . 10.0 109.379 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -67.76 -26.25 66.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 10.0 113.088 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.918 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 89.3 mttt -108.96 -74.64 0.02 OUTLIER Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 112.786 0.661 . . . . 10.0 112.786 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.918 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 46.6 Cg_exo -58.69 -56.74 1.3 Allowed 'Trans proline' 0 C--N 1.357 1.015 0 C-N-CA 122.168 1.912 . . . . 10.0 113.167 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -58.31 -48.59 80.02 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.094 0.405 . . . . 10.0 112.094 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.482 HD23 HD12 ' A' ' 371' ' ' LEU . 11.5 mt -62.3 -39.19 92.19 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.45 0.166 . . . . 10.0 110.975 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 365' ' ' LYS . 14.5 tt0 -61.3 -47.67 84.88 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.291 -0.633 . . . . 10.0 109.291 178.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.86 -43.64 98.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 10.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . 0.482 HD12 HD23 ' A' ' 368' ' ' LEU . 66.4 mt -61.17 -45.38 94.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.929 -0.578 . . . . 10.0 110.551 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.413 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 82.1 mtt180 -66.2 -41.23 90.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.601 179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.2 -37.63 80.83 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.903 0.382 . . . . 10.0 110.058 178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -80.24 -23.21 61.46 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.868 -0.682 . . . . 10.0 111.677 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 12.8 mt -76.07 -30.43 58.34 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.438 0.162 . . . . 10.0 111.438 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 91.8 mt -53.67 -58.56 12.57 Favored Pre-proline 0 CA--C 1.531 0.241 0 O-C-N 123.313 0.383 . . . . 10.0 111.532 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.23 -30.25 81.4 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.009 1.806 . . . . 10.0 111.141 178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 35.8 t -64.46 -42.34 94.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 109.407 -0.59 . . . . 10.0 109.407 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.96 -35.94 81.09 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.194 -0.669 . . . . 10.0 109.194 178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.443 ' O ' HG23 ' A' ' 384' ' ' VAL . 46.7 mm-40 -61.56 -51.76 67.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.721 -0.672 . . . . 10.0 109.338 178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 2.3 p -63.65 -36.65 84.54 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.008 -0.542 . . . . 10.0 111.065 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -42.5 95.74 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.737 179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -67.08 -41.64 86.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.209 -0.451 . . . . 10.0 111.031 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 380' ' ' GLU . 72.7 t -61.35 -45.42 98.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 10.0 110.049 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 4.3 p -70.47 -40.6 73.57 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.351 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.07 -41.08 87.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 116.208 -0.451 . . . . 10.0 110.932 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 391' ' ' GLU . 47.4 mt -60.6 -49.68 76.55 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.754 -0.657 . . . . 10.0 110.712 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.86 -37.34 87.02 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.314 -0.403 . . . . 10.0 111.276 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -61.85 -41.95 98.45 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.429 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . . . . . . . . . 50.5 mt -63.22 -41.41 99.11 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.049 -0.523 . . . . 10.0 110.415 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 387' ' ' LEU . 37.0 mt-10 -65.08 -43.26 92.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.771 -0.649 . . . . 10.0 110.441 179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -53.62 -50.19 66.23 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.912 -0.585 . . . . 10.0 111.45 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -65.22 -42.08 93.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 10.0 111.455 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.7 m -68.83 -19.4 64.27 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.359 -0.382 . . . . 10.0 111.947 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -91.78 -41.62 10.57 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.267 0.469 . . . . 10.0 112.267 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . 0.584 ' HG2' ' HB2' ' C' ' 587' ' ' ALA . 0.6 OUTLIER -88.2 -25.48 22.89 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.775 1.028 . . . . 10.0 113.775 -178.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 72.4 mt -108.2 10.8 27.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.81 0.338 . . . . 10.0 111.342 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 3.7 t30 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.228 -0.442 . . . . 10.0 110.95 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 121.321 0.581 . . . . 10.0 110.111 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 31.33 6.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.236 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 72.7 mt -70.6 -42.74 70.59 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.559 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 74.7 mt -65.12 -32.6 74.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -67.83 -43.07 80.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.668 -0.696 . . . . 10.0 110.581 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . 0.473 ' O ' HG23 ' C' ' 408' ' ' VAL . 25.8 t-20 -73.26 -36.51 66.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.96 -0.564 . . . . 10.0 109.551 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -33.97 74.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 109.235 -0.654 . . . . 10.0 109.235 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.88 -46.48 89.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.25 -0.887 . . . . 10.0 109.805 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.69 -40.15 96.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.289 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . 0.473 HG23 ' O ' ' C' ' 404' ' ' ASN . 62.0 t -63.02 -45.91 97.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-O 120.953 0.406 . . . . 10.0 110.231 179.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 13.6 m -63.33 -34.08 76.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.173 -0.467 . . . . 10.0 109.908 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 18.8 m -64.73 -45.8 84.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.587 -0.523 . . . . 10.0 109.587 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.24 -32.79 74.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 10.0 110.413 178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -70.43 -38.52 74.56 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 23.2 m -66.63 -41.37 88.42 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.229 -0.656 . . . . 10.0 109.229 178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.462 ' HE3' ' HG3' ' A' ' 362' ' ' GLU . 2.0 mmtm -65.4 -31.66 72.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 121.444 0.64 . . . . 10.0 109.502 178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' C' ' 419' ' ' LEU . 1.8 tt -67.17 -40.07 86.55 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.532 -0.914 . . . . 10.0 108.532 177.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' C' ' 419' ' ' LEU . 83.9 mtt180 -67.49 -34.55 77.38 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.033 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -64.14 -25.86 68.27 Favored 'General case' 0 CA--C 1.523 -0.094 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.543 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -85.56 -46.7 10.58 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.276 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' C' ' 416' ' ' ARG . 88.3 mt -45.15 -53.0 8.63 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 124.131 0.895 . . . . 10.0 112.432 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -51.55 -76.1 0.19 Allowed Glycine 0 CA--C 1.523 0.577 0 O-C-N 123.423 0.452 . . . . 10.0 113.622 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -53.89 -42.52 65.94 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.051 2.5 . . . . 10.0 112.824 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.26 -45.87 97.75 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.37 0 N-CA-C 111.978 0.362 . . . . 10.0 111.978 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 25.6 p -67.71 -33.74 75.49 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.253 -0.579 . . . . 10.0 111.275 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -60.76 -49.87 75.77 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.233 -0.44 . . . . 10.0 109.913 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -76.09 -26.62 56.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.665 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 54.7 t80 -67.34 -42.25 83.84 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 179.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -66.91 -38.5 86.34 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.665 -0.865 . . . . 10.0 108.665 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.505 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 32.6 t70 -64.0 -36.51 84.2 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.482 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 3.1 t30 -68.63 -43.73 75.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.391 -0.822 . . . . 10.0 108.903 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 88.9 mt -58.83 -39.07 80.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.602 -0.726 . . . . 10.0 109.936 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.52 -34.3 77.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.25 178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 46.1 mttp -71.77 -46.58 57.94 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -62.74 -49.04 76.61 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.332 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 11.4 p -59.12 -51.6 69.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.517 0.199 . . . . 10.0 111.198 -179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.639 ' O ' ' HG3' ' C' ' 439' ' ' GLN . 21.0 mm-40 -63.51 -43.28 97.65 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.795 -0.184 . . . . 10.0 111.124 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -59.02 -49.54 77.41 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.856 -0.898 . . . . 10.0 110.856 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 81.1 mt -64.38 -31.03 72.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.401 179.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.81 -27.07 64.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.121 -0.49 . . . . 10.0 111.05 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 84.9 mt-30 -73.74 -38.33 64.8 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.224 -1.028 . . . . 10.0 108.224 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 42.8 mt-10 -72.8 -41.32 65.07 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.378 -0.828 . . . . 10.0 109.668 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -66.14 -41.09 90.93 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.029 0.751 . . . . 10.0 113.029 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 13.7 p -59.11 -49.71 76.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.914 0.388 . . . . 10.0 110.156 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.24 -36.22 81.18 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.196 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.597 ' O ' ' HB ' ' C' ' 448' ' ' VAL . 0.9 OUTLIER -64.87 -51.68 60.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.755 -0.657 . . . . 10.0 110.959 -179.936 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . 0.454 ' O ' HG12 ' C' ' 448' ' ' VAL . 88.7 mt -65.74 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.896 -0.593 . . . . 10.0 111.478 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -62.17 -47.74 83.16 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.767 0.318 . . . . 10.0 111.428 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.628 ' HB3' HH21 ' A' ' 330' ' ' ARG . 6.2 tt0 -70.05 -28.45 65.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.744 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.597 ' HB ' ' O ' ' C' ' 444' ' ' ASP . 0.3 OUTLIER -71.48 -32.25 45.62 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 120.91 -0.316 . . . . 10.0 110.26 179.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' C' ' 445' ' ' LEU . 90.5 mttt -66.06 -36.02 82.09 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 10.0 109.244 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -83.59 -0.46 50.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.311 -0.858 . . . . 10.0 110.468 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 38.0 mttp -110.34 -35.9 5.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.309 -0.405 . . . . 10.0 110.824 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.454 HG23 ' O ' ' C' ' 448' ' ' VAL . 42.0 t -60.57 -42.38 91.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.941 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . 0.538 ' HB2' ' HD3' ' C' ' 454' ' ' PRO . 37.4 mt-30 -57.14 -60.22 10.31 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.784 -0.189 . . . . 10.0 111.219 179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.538 ' HD3' ' HB2' ' C' ' 453' ' ' GLN . 28.1 Cg_endo -65.09 -30.27 56.02 Favored 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 121.65 1.566 . . . . 10.0 112.272 178.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 19.0 t80 -65.15 -46.8 79.39 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.086 -0.709 . . . . 10.0 109.086 178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 24.8 mt -67.89 -39.55 83.63 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.972 178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -64.17 -48.49 75.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 10.0 110.514 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.02 -37.0 85.83 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.97 -40.65 68.47 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.648 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -57.56 -46.6 83.74 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.812 -0.631 . . . . 10.0 109.353 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . . . . . . . . . 70.7 mttt -56.25 -46.57 79.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.433 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' C' ' 466' ' ' GLU . 28.4 mtmm -67.1 -43.98 81.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 10.0 111.252 179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -62.58 -46.04 90.13 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 123.268 0.355 . . . . 10.0 110.416 179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' C' ' 468' ' ' GLU . 58.5 mt-30 -61.75 -49.14 77.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.242 -0.435 . . . . 10.0 109.998 179.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' C' ' 469' ' ' LEU . 19.4 mt-10 -58.72 -48.07 82.41 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 110.042 -0.355 . . . . 10.0 110.042 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . 0.538 ' OE2' H262 ' C' ' 602' ' ' PCW . 0.5 OUTLIER -59.69 -43.06 94.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.994 -0.548 . . . . 10.0 110.341 179.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 48.3 ttm -63.08 -43.46 98.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.184 -0.462 . . . . 10.0 110.454 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' C' ' 464' ' ' GLN . 24.6 mt-10 -65.87 -36.41 83.34 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.501 -0.555 . . . . 10.0 109.501 178.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' C' ' 465' ' ' GLU . 72.6 mt -65.43 -29.6 70.3 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.831 -0.622 . . . . 10.0 109.651 178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -69.43 -36.63 76.84 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.755 -0.832 . . . . 10.0 108.755 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.888 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 75.0 mtt85 -74.07 -28.4 61.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.54 179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -89.34 -16.31 31.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.861 -0.609 . . . . 10.0 112.264 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.484 ' NZ ' HD22 ' C' ' 469' ' ' LEU . 50.5 mttp -124.86 -62.87 1.21 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.678 0.622 . . . . 10.0 112.678 -178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -47.0 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.224 0.453 . . . . 10.0 112.224 -178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.888 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 9.8 mt-10 -59.94 -56.18 38.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 112.234 0.457 . . . . 10.0 112.234 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . 0.675 ' HD3' ' HB2' ' C' ' 475' ' ' GLU . 48.7 Cg_exo -61.23 -32.46 90.49 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 122.063 1.842 . . . . 10.0 110.754 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 6.0 mt -63.87 -41.07 97.85 Favored 'General case' 0 C--O 1.222 -0.349 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -59.29 -34.22 72.03 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 116.102 -0.499 . . . . 10.0 109.928 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -67.05 -49.02 66.52 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.893 -0.41 . . . . 10.0 109.893 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.49 -41.2 98.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.104 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 96.8 mt -67.09 -40.07 86.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.584 179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -65.9 -38.75 89.54 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.833 -0.432 . . . . 10.0 109.833 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.62 -41.48 92.63 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 109.206 -0.664 . . . . 10.0 109.206 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -68.66 -35.49 80.72 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.351 -1.099 . . . . 10.0 110.351 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.33 -43.12 82.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.748 -0.464 . . . . 10.0 109.748 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -62.63 -41.87 99.27 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.401 -0.592 . . . . 10.0 109.401 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -64.78 -41.88 95.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.676 -0.861 . . . . 10.0 108.676 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 44.3 tttt -64.0 -34.96 79.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.75 -0.659 . . . . 10.0 110.189 178.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . 0.536 ' O ' ' HG3' ' C' ' 493' ' ' GLN . 47.0 mt -62.44 -43.3 99.15 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.235 -1.024 . . . . 10.0 108.235 177.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -64.3 -44.38 91.79 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.651 -0.87 . . . . 10.0 108.651 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -56.19 -47.02 79.15 Favored 'General case' 0 CA--C 1.523 -0.063 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.43 -42.58 95.94 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.173 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . 0.536 ' HG3' ' O ' ' C' ' 489' ' ' LEU . 98.6 mt-30 -57.47 -45.64 84.58 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.104 0.478 . . . . 10.0 110.577 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.64 -10.39 45.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.562 -0.745 . . . . 10.0 111.271 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.566 ' HA ' HD13 ' C' ' 499' ' ' LEU . 29.4 mttp -118.4 5.17 11.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.21 0.528 . . . . 10.0 110.322 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.478 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 21.1 mt -117.23 -32.74 4.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.06 -0.518 . . . . 10.0 110.741 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' C' ' 501' ' ' GLU . 70.1 m -79.49 -69.68 0.19 Allowed Pre-proline 0 C--N 1.323 -0.548 0 N-CA-C 112.125 0.417 . . . . 10.0 112.125 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.429 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 30.4 Cg_endo -64.92 -43.48 11.98 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 121.409 1.406 . . . . 10.0 111.304 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' C' ' 495' ' ' LYS . 7.9 mp -71.63 -32.08 67.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.618 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.478 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -67.05 -46.46 72.6 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.855 -0.898 . . . . 10.0 110.855 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' C' ' 497' ' ' SER . 44.5 mt-10 -63.37 -36.35 83.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.281 0.562 . . . . 10.0 109.505 178.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.649 ' HG2' ' HE ' ' C' ' 506' ' ' ARG . 29.4 tt0 -65.07 -47.76 76.13 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.43 -0.805 . . . . 10.0 109.616 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.584 ' HA ' ' HD2' ' C' ' 506' ' ' ARG . 88.5 mmm -59.61 -36.18 75.81 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.984 0.421 . . . . 10.0 110.058 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -68.65 -38.32 80.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.52 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.546 ' HA ' ' HD2' ' C' ' 508' ' ' ARG . 11.3 t70 -70.11 -36.81 75.11 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.649 ' HE ' ' HG2' ' C' ' 502' ' ' GLU . 53.9 mtt180 -60.51 -46.65 89.35 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.55 -1.278 . . . . 10.0 107.55 177.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.72 75.57 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.013 -0.994 . . . . 10.0 110.144 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.546 ' HD2' ' HA ' ' C' ' 505' ' ' ASP . 58.1 mtt180 -63.34 -45.23 92.19 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.427 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -63.77 -34.41 77.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.479 179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . 0.518 ' O ' ' HG ' ' C' ' 514' ' ' LEU . 42.9 m-70 -73.83 -48.47 31.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 10.0 110.617 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.452 ' O ' ' HG3' ' C' ' 515' ' ' ARG . 82.7 t -65.3 -41.14 90.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.564 -0.289 . . . . 10.0 110.924 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.509 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 18.4 t70 -60.75 -37.07 80.59 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -63.7 -47.4 81.32 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.479 -0.934 . . . . 10.0 108.479 177.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' C' ' 510' ' ' HIS . 86.5 mt -57.61 -36.37 71.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.855 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 69.3 mtt180 -63.75 -25.71 68.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.948 0.404 . . . . 10.0 110.751 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.64 -0.18 17.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.424 0.63 . . . . 10.0 110.744 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . 0.473 ' O ' ' HB2' ' C' ' 521' ' ' TYR . 21.8 m170 -111.45 -54.27 2.62 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.101 -0.499 . . . . 10.0 111.063 -179.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 87.2 mt -79.85 -47.88 14.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.431 0.53 . . . . 10.0 112.431 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.711 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -54.04 -59.61 9.49 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 112.727 0.64 . . . . 10.0 112.727 -179.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.6 Cg_exo -61.27 -40.36 50.38 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.016 1.81 . . . . 10.0 111.804 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . 0.473 ' HB2' ' O ' ' C' ' 517' ' ' HIS . 8.0 t80 -64.11 -43.32 95.7 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.453 -0.34 . . . . 10.0 111.757 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' C' ' 526' ' ' ARG . 65.1 p -63.66 -32.76 74.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.066 0.46 . . . . 10.0 110.09 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . 0.804 ' HA ' ' HD2' ' C' ' 526' ' ' ARG . 26.2 t70 -72.12 -39.94 68.5 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.681 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -70.51 -32.43 69.92 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.859 -0.793 . . . . 10.0 108.859 177.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 0.5 OUTLIER -67.68 -25.27 65.61 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.474 -0.785 . . . . 10.0 109.117 178.237 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . 0.804 ' HD2' ' HA ' ' C' ' 523' ' ' ASP . 88.8 mtt180 -64.19 -32.19 73.68 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -69.89 -39.36 76.31 Favored 'General case' 0 CA--C 1.519 -0.223 0 N-CA-C 108.594 -0.891 . . . . 10.0 108.594 178.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.565 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 88.8 mtt180 -67.75 -43.88 78.86 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.152 -1.055 . . . . 10.0 108.152 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 93.9 mt -63.72 -32.63 74.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.993 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . . . . . . . . . . . -66.23 -49.59 66.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.58 -0.526 . . . . 10.0 109.58 178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.93 -41.27 99.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.23 -0.655 . . . . 10.0 109.23 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . 0.418 ' O ' ' HG ' ' C' ' 536' ' ' LEU . 6.7 ttm180 -62.71 -48.7 78.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.943 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 17.7 mt -63.33 -42.11 98.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 10.0 111.006 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.785 ' HA ' ' HE3' ' C' ' 537' ' ' LYS . 59.2 mt-10 -62.59 -41.4 98.94 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-O 120.806 0.336 . . . . 10.0 110.158 178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . 0.54 ' O ' ' HB2' ' C' ' 539' ' ' ASN . . . -63.95 -42.02 97.43 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.033 -0.729 . . . . 10.0 109.033 178.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' C' ' 532' ' ' ARG . 96.0 mt -71.46 -19.44 62.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.785 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' C' ' 534' ' ' GLU . 37.7 mtmt -81.96 -44.7 16.37 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.323 -0.621 . . . . 10.0 109.323 178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -68.67 -43.4 76.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.165 -0.679 . . . . 10.0 109.165 178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . 0.54 ' HB2' ' O ' ' C' ' 535' ' ' ALA . 1.6 m-20 -72.03 -35.48 69.39 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.161 -0.681 . . . . 10.0 109.161 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . . . . . . . . . . . -66.03 -48.61 64.11 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.273 -0.731 . . . . 10.0 111.273 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -60.86 -41.63 99.3 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.492 -1.043 . . . . 10.0 110.492 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.84 -48.64 75.97 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.691 -0.485 . . . . 10.0 109.691 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' C' ' 543' ' ' ARG . 50.1 mtt180 -60.5 -36.86 79.36 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.147 -0.479 . . . . 10.0 110.388 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . . . . . . . . . 49.9 mt -63.01 -44.35 96.21 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.475 -0.565 . . . . 10.0 109.475 178.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.86 91.4 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.516 -0.765 . . . . 10.0 109.76 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.32 -47.44 82.22 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.247 178.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.07 -34.25 75.92 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.137 -0.483 . . . . 10.0 109.878 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -73.46 -45.99 50.92 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.362 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' C' ' 553' ' ' GLU . . . -62.48 -47.07 85.59 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -30.11 71.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.381 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -65.52 -43.34 90.34 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.573 -0.529 . . . . 10.0 109.573 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.98 -39.59 79.34 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 178.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 549' ' ' ALA . 54.2 mt-10 -62.38 -49.02 77.2 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.083 -0.71 . . . . 10.0 109.083 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.408 ' HD2' ' HG ' ' C' ' 558' ' ' LEU . 2.5 t60 -63.61 -37.02 85.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.611 -0.722 . . . . 10.0 109.361 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . 0.455 ' HA ' HD12 ' C' ' 558' ' ' LEU . 31.5 tp -59.31 -43.96 92.6 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.978 179.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 31.7 m -62.9 -41.68 99.52 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.042 -0.526 . . . . 10.0 109.671 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 1.7 m -68.9 -30.8 69.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.768 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' C' ' 555' ' ' LEU . 47.1 mt -61.31 -59.85 4.65 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.991 -0.55 . . . . 10.0 109.655 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 3.9 m -62.94 -32.77 74.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.542 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -59.19 -30.48 68.24 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.617 -0.72 . . . . 10.0 110.812 179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . 0.531 ' HB2' ' HZ2' ' C' ' 561' ' ' LYS . 0.0 OUTLIER -103.85 -40.81 6.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.274 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -56.15 -37.66 69.8 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.462 0.542 . . . . 10.0 112.462 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -63.03 -65.4 2.15 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 111.938 0.347 . . . . 10.0 111.938 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -62.2 -33.35 81.7 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 121.806 1.671 . . . . 10.0 112.477 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.31 -56.71 12.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.934 -0.121 . . . . 10.0 110.946 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . 0.407 HD23 HD12 ' C' ' 569' ' ' LEU . 41.1 mt -60.12 -35.25 74.85 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 120.786 0.327 . . . . 10.0 110.704 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -62.63 -51.82 65.78 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.291 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.82 -30.18 67.63 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 115.95 -0.568 . . . . 10.0 110.992 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . 0.407 HD12 HD23 ' C' ' 566' ' ' LEU . 49.5 mt -64.48 -45.87 85.52 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.553 -0.536 . . . . 10.0 109.553 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -70.98 -47.01 61.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.567 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -62.42 -24.31 67.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.177 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . . . . . . . . . . . -91.5 -36.81 6.37 Favored Glycine 0 N--CA 1.444 -0.804 0 N-CA-C 111.545 -0.622 . . . . 10.0 111.545 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . 0.549 ' O ' ' HG ' ' C' ' 577' ' ' LEU . 19.1 mt -70.78 -35.18 72.46 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 111.605 0.224 . . . . 10.0 111.605 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' C' ' 578' ' ' GLU . 78.9 mt -50.66 -59.71 6.84 Favored Pre-proline 0 CA--C 1.534 0.353 0 N-CA-C 112.629 0.603 . . . . 10.0 112.629 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.06 -32.25 44.27 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.659 1.572 . . . . 10.0 111.057 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . . . . . . . . . 9.8 t -64.34 -42.95 96.92 Favored 'Isoleucine or valine' 0 C--O 1.23 0.076 0 N-CA-C 110.192 -0.299 . . . . 10.0 110.192 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' C' ' 573' ' ' LEU . 87.3 mt -61.56 -42.84 99.43 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.767 -0.457 . . . . 10.0 109.767 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' C' ' 574' ' ' LEU . 14.1 mm-40 -63.24 -44.89 93.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.877 -0.601 . . . . 10.0 109.923 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 19.6 m -65.46 -37.39 86.75 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.084 0.468 . . . . 10.0 109.819 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -64.67 -42.5 95.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.111 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.78 -48.27 75.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.755 -0.461 . . . . 10.0 109.755 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . . . . . . . . . 60.4 t -59.96 -46.63 93.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.78 -0.645 . . . . 10.0 110.17 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 12.4 m -62.29 -39.6 93.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.826 -0.624 . . . . 10.0 110.866 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -70.02 -46.88 64.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.427 -0.351 . . . . 10.0 110.888 179.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . . . . . . . . . 68.4 mt -60.67 -47.14 87.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.375 -0.375 . . . . 10.0 111.338 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 12.3 p -63.54 -30.89 71.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.13 0.491 . . . . 10.0 110.561 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . 0.584 ' HB2' ' HG2' ' A' ' 396' ' ' LYS . . . -71.61 -51.45 23.2 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.511 -0.552 . . . . 10.0 109.511 178.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 84.6 mt -59.22 -48.6 81.01 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.885 -0.598 . . . . 10.0 111.15 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' C' ' 593' ' ' LYS . 68.0 mt-10 -54.26 -46.65 72.69 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 116.208 -0.451 . . . . 10.0 111.33 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -75.65 -40.15 56.58 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.233 0.457 . . . . 10.0 112.233 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -59.09 -41.34 87.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.786 0.327 . . . . 10.0 111.58 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 7.1 m -64.21 -29.27 70.39 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.063 -0.517 . . . . 10.0 111.185 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' C' ' 589' ' ' GLU . 86.5 mttt -83.72 -27.55 28.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.265 -0.425 . . . . 10.0 110.904 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -77.73 -42.53 33.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.163 -0.471 . . . . 10.0 111.28 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 94.8 mt -93.41 25.09 3.57 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.194 -0.457 . . . . 10.0 111.435 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 121.165 0.507 . . . . 10.0 111.453 -179.892 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.558 0.218 . . . . 10.0 110.978 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.35 133.8 46.24 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.224 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -98.08 137.94 36.12 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.702 0.287 . . . . 10.0 111.325 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -124.85 123.56 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.19 -0.459 . . . . 10.0 110.566 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 12.3 mmtm -92.72 117.83 30.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.661 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.3 mt -119.64 138.83 53.0 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 116.121 -0.491 . . . . 10.0 111.711 -179.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 71.5 t -137.01 117.6 17.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.808 -0.633 . . . . 10.0 109.954 179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 m -93.4 148.97 4.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.429 -0.351 . . . . 10.0 110.993 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.9 m -135.73 139.09 46.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.241 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 176.69 -175.63 47.65 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.884 -0.674 . . . . 10.0 112.39 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.33 174.99 7.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.953 0.406 . . . . 10.0 111.074 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.26 111.94 3.35 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.69 -0.767 . . . . 10.0 112.701 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.71 34.16 2.9 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.777 -0.725 . . . . 10.0 112.729 179.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.413 ' N ' ' O2B' ' B' ' 216' ' ' GNP . 33.4 m -112.81 -14.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 112.436 0.532 . . . . 10.0 112.436 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 112.04 14.88 10.45 Favored Glycine 0 C--O 1.225 -0.433 0 C-N-CA 120.547 -0.835 . . . . 10.0 111.303 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.49 ' HG2' ' OD2' ' B' ' 57' ' ' ASP . 8.9 ttpp -50.22 -57.75 7.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 122.673 0.389 . . . . 10.0 111.537 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.42 -39.95 15.85 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.583 0.23 . . . . 10.0 110.493 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.04 -52.52 50.4 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.744 HD23 ' HB2' ' B' ' 146' ' ' ALA . 80.5 mt -58.18 -47.88 82.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.032 0.444 . . . . 10.0 111.453 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 1.2 m -63.91 -42.45 97.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.915 -0.584 . . . . 10.0 112.144 -179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.515 HD13 HG13 ' D' ' 388' ' ' VAL . 49.3 mt -66.36 -35.69 75.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.954 0.407 . . . . 10.0 110.323 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.547 ' O ' ' HA ' ' B' ' 26' ' ' ASN . 24.5 tp60 -75.22 -35.55 61.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.286 -0.416 . . . . 10.0 111.816 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 16.0 tp -86.17 -27.04 24.81 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.555 0.576 . . . . 10.0 112.555 -178.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 47.9 mm -98.88 -59.91 3.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 112.027 0.38 . . . . 10.0 112.027 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -78.98 -18.36 53.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.869 0.366 . . . . 10.0 111.038 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.0 m-20 72.6 22.82 3.18 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.46 -0.791 . . . . 10.0 112.564 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -124.19 145.18 49.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.453 -0.34 . . . . 10.0 110.573 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -105.48 140.35 38.7 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.042 0.449 . . . . 10.0 110.506 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . 0.442 HG23 " O2'" ' B' ' 216' ' ' GNP . 20.4 m -83.52 167.72 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.209 179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -120.21 -49.2 2.29 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.03 0.443 . . . . 10.0 110.482 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' B' ' 31' ' ' GLU . 0.5 OUTLIER -102.01 160.6 14.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.527 -0.76 . . . . 10.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.489 ' HE1' ' PG ' ' B' ' 216' ' ' GNP . 41.0 t80 -97.43 141.0 31.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.12 0.485 . . . . 10.0 111.419 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -138.52 122.94 11.67 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.544 -0.753 . . . . 10.0 109.123 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -51.27 99.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.942 2.428 . . . . 10.0 111.547 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 2.5 m -82.17 119.27 23.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.943 -0.571 . . . . 10.0 110.753 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.676 HD11 ' HB2' ' D' ' 371' ' ' ASN . 54.0 mt -96.94 -54.25 7.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.822 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.787 ' HB3' HG23 ' D' ' 369' ' ' VAL . 33.9 tt0 -151.18 125.83 9.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.736 0.303 . . . . 10.0 110.925 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -144.63 151.69 39.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.56 141.78 50.73 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -133.74 141.54 47.57 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.347 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -142.75 136.83 29.3 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.228 0.33 . . . . 10.0 110.599 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -139.99 145.9 38.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.797 -0.183 . . . . 10.0 111.427 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -110.14 89.36 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.083 -0.508 . . . . 10.0 109.661 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . 0.55 HG12 HH22 ' D' ' 464' ' ' ARG . 0.0 OUTLIER -127.52 174.01 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.092 0.472 . . . . 10.0 112.018 -179.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' B' ' 50' ' ' THR . 60.9 t -101.76 129.96 52.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.501 -0.772 . . . . 10.0 111.121 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.655 HG21 HG21 ' B' ' 160' ' ' VAL . 85.1 mt -127.41 112.77 29.25 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.18 179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.481 ' H ' ' HE1' ' B' ' 157' ' ' TYR . 13.7 t70 65.98 29.57 10.12 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.671 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.67 -17.78 53.09 Favored Glycine 0 N--CA 1.451 -0.31 0 CA-C-N 115.563 -0.744 . . . . 10.0 112.716 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -103.79 128.41 51.2 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.788 0.328 . . . . 10.0 110.598 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' B' ' 45' ' ' VAL . 2.0 m -62.9 129.49 40.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.132 -0.486 . . . . 10.0 110.07 179.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 68.9 m -130.7 150.13 52.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.989 0.423 . . . . 10.0 111.654 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 15.6 tp -107.06 114.57 28.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.64 . . . . 10.0 109.712 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.88 109.67 20.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.924 0.392 . . . . 10.0 111.372 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -103.36 100.15 10.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 4.5 mt -110.77 137.71 42.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.992 -0.549 . . . . 10.0 111.478 -178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 tp -125.24 124.21 41.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.08 -0.711 . . . . 10.0 109.08 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.49 ' OD2' ' HG2' ' B' ' 16' ' ' LYS . 23.9 t0 -80.09 149.04 30.77 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.34 -0.391 . . . . 10.0 111.641 -179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 6.1 p -103.64 -163.69 1.0 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.547 -0.751 . . . . 10.0 109.835 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.499 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -124.08 117.96 25.86 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.336 -0.616 . . . . 10.0 109.336 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.54 -57.5 10.03 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.815 -0.707 . . . . 10.0 112.626 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -84.98 82.53 8.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.115 0.483 . . . . 10.0 111.133 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . 0.429 ' HB3' ' NH2' ' B' ' 68' ' ' ARG . 39.3 tt0 -164.16 152.33 12.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.301 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -90.37 -173.39 3.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.027 -0.533 . . . . 10.0 109.627 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . . . . . . . . . 47.3 t80 -68.34 110.21 3.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.419 0.628 . . . . 10.0 111.66 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.19 139.29 40.93 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.271 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -59.84 -38.44 82.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.29 . . . . 10.0 111.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 19.3 mmm -64.62 -35.05 79.76 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.747 0.308 . . . . 10.0 111.349 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.642 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 15.9 ttm180 -61.35 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.877 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -56.61 -33.72 66.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.324 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -69.21 -64.71 0.82 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.577 -0.738 . . . . 10.0 112.918 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.642 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 20.1 p90 -64.2 -25.75 68.21 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 113.222 0.823 . . . . 10.0 113.222 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.457 ' HE3' HG21 ' B' ' 103' ' ' VAL . 13.7 ttp -69.96 -28.19 65.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 10.0 110.12 178.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 29.8 ttm105 -77.3 -33.06 55.74 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 26.4 m -65.35 -37.45 87.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.501 -0.772 . . . . 10.0 110.332 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.65 145.38 48.91 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.946 -0.645 . . . . 10.0 112.651 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -106.91 -57.88 2.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.873 0.368 . . . . 10.0 111.248 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -95.49 127.48 9.16 Favored Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.575 -0.822 . . . . 10.0 111.159 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.482 ' HB2' ' HG3' ' B' ' 111' ' ' MET . 60.0 m-85 -116.15 135.2 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 10.0 111.868 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.581 HD23 ' HB ' ' B' ' 112' ' ' VAL . 63.0 mt -119.37 113.37 20.7 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.45 -0.796 . . . . 10.0 109.704 178.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' B' ' 113' ' ' LEU . 3.8 m -77.23 99.45 5.47 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 10.0 109.581 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . . . . . . . . . 11.4 m -91.77 131.67 38.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 120.853 0.359 . . . . 10.0 111.108 -179.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.8 ' HB3' HD11 ' B' ' 93' ' ' ILE . 9.4 p90 -150.99 156.4 41.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 10.0 110.744 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.437 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -95.43 126.02 40.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.822 -0.627 . . . . 10.0 109.732 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.643 HD13 ' HG3' ' B' ' 123' ' ' ARG . 2.6 pp -72.07 -13.11 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.894 0.331 . . . . 10.0 111.894 -179.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.437 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 8.0 p-10 -88.15 3.83 47.76 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.975 0.416 . . . . 10.0 110.569 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . 0.452 HD21 ' HB3' ' B' ' 88' ' ' LYS . 52.5 t30 -135.39 114.24 11.98 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.279 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.25 -27.88 68.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.252 -0.431 . . . . 10.0 111.769 -179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . 0.452 ' HB3' HD21 ' B' ' 86' ' ' ASN . 17.8 tptp -57.95 -47.77 81.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.121 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.704 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -60.71 -39.38 88.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.041 -0.527 . . . . 10.0 111.846 -179.606 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -60.98 -41.26 96.08 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.98 0.419 . . . . 10.0 111.486 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -78.14 -29.62 48.87 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.697 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.55 -15.23 60.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.263 -0.426 . . . . 10.0 111.676 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.8 HD11 ' HB3' ' B' ' 82' ' ' PHE . 17.8 mm -57.06 -46.33 84.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.891 179.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' B' ' 98' ' ' GLU . 85.2 t60 -61.91 -36.49 81.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.956 -0.565 . . . . 10.0 111.393 -179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -59.68 -52.28 66.19 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.817 0.341 . . . . 10.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -66.67 -32.06 73.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.124 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.415 ' HD3' ' OE1' ' B' ' 98' ' ' GLU . 1.8 ttt180 -60.71 -45.01 95.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.792 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.415 ' OE1' ' HD3' ' B' ' 97' ' ' ARG . 24.5 mm-40 -67.07 -36.42 81.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.539 -0.755 . . . . 10.0 110.384 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -63.1 -49.72 73.34 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.805 -0.634 . . . . 10.0 110.693 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.22 -40.32 83.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.682 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -58.99 -41.58 87.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.848 -0.615 . . . . 10.0 111.487 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 42.1 ttp85 -70.99 -39.67 72.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 10.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.457 HG21 ' HE3' ' B' ' 72' ' ' MET . 70.4 t -65.95 -52.02 53.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.279 -0.419 . . . . 10.0 111.01 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -74.17 -11.47 60.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.426 -0.352 . . . . 10.0 111.03 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 22.5 t0 56.38 42.69 27.33 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.528 0.68 . . . . 10.0 111.357 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 44.3 m -153.86 135.44 14.34 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.733 -0.667 . . . . 10.0 109.778 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -77.95 -31.75 51.11 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.942 0.401 . . . . 10.0 110.714 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -102.81 96.12 6.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.349 0.595 . . . . 10.0 112.067 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 m -135.55 151.21 74.13 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.722 179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.95 105.36 0.95 Allowed 'Trans proline' 0 CA--C 1.529 0.262 0 C-N-CA 122.597 2.198 . . . . 10.0 112.247 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.482 ' HG3' ' HB2' ' B' ' 78' ' ' PHE . 6.7 ttm -138.6 104.54 5.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 10.0 110.144 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.607 HG22 ' HG2' ' B' ' 140' ' ' PRO . 21.8 t -99.53 138.55 23.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.773 -179.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' B' ' 80' ' ' CYS . 30.2 tp -86.71 131.52 34.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.322 -0.399 . . . . 10.0 110.134 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' B' ' 142' ' ' ILE . 59.8 t -122.26 112.15 33.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 120.801 0.334 . . . . 10.0 111.149 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.66 106.88 3.46 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.037 -0.825 . . . . 10.0 111.037 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -99.46 168.15 10.16 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.557 0.217 . . . . 10.0 111.037 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.422 ' HG2' ' C6 ' ' B' ' 216' ' ' GNP . 96.8 mttt 66.88 24.38 9.74 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.426 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.452 ' HA ' HD11 ' B' ' 84' ' ' ILE . 12.7 p -71.47 -17.86 62.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.743 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.69 -24.12 60.97 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.252 -0.431 . . . . 10.0 110.048 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' B' ' 121' ' ' PRO . 76.2 mt -69.93 132.45 88.6 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 10.0 110.305 179.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' B' ' 120' ' ' LEU . 33.2 Cg_exo -62.74 -20.2 70.41 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 123.058 2.505 . . . . 10.0 112.668 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 2.9 m -79.06 49.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.147 0.499 . . . . 10.0 111.259 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.643 ' HG3' HD13 ' B' ' 84' ' ' ILE . 34.7 ttm-85 -73.28 97.47 2.47 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 10.0 111.247 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 4.4 m -79.17 -49.54 12.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.088 0.47 . . . . 10.0 110.241 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 41.3 t -81.91 121.41 35.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.533 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -81.84 146.05 30.07 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.864 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 1.3 m -59.49 -36.74 76.6 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.634 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.502 ' HE2' H332 ' A' ' 402' ' ' PCW . 4.3 tmtm? -66.2 -30.03 70.41 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.285 -0.416 . . . . 10.0 111.097 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -72.67 -43.52 63.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.906 0.384 . . . . 10.0 110.346 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.39 -47.15 74.26 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.01 -0.541 . . . . 10.0 111.366 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -65.69 -31.85 73.08 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.164 -0.471 . . . . 10.0 110.922 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.471 ' HB2' ' O ' ' B' ' 128' ' ' LYS . 13.7 t70 -59.17 -57.35 13.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 10.0 111.142 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.33 -41.01 94.39 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.66 -0.7 . . . . 10.0 111.228 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.2 -46.2 89.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.794 -0.639 . . . . 10.0 112.008 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -67.42 -32.57 73.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.497 -0.32 . . . . 10.0 111.342 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.9 m -69.8 -29.78 67.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.063 0.458 . . . . 10.0 111.028 179.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -86.89 -41.95 13.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.297 -0.41 . . . . 10.0 110.728 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 108.32 33.29 2.98 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.02 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 1.9 pt -127.3 136.83 29.48 Favored Pre-proline 0 C--N 1.328 -0.337 0 O-C-N 122.853 -0.204 . . . . 10.0 110.581 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.607 ' HG2' HG22 ' B' ' 112' ' ' VAL . 35.5 Cg_endo -64.78 160.0 42.84 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 123.337 2.691 . . . . 10.0 113.288 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -139.47 124.15 18.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.481 -0.782 . . . . 10.0 109.759 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.734 HD12 ' H62' ' B' ' 210' ' ' PCW . 29.9 mm -120.1 109.85 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.91 0.386 . . . . 10.0 110.623 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -92.18 119.37 31.76 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.671 -0.863 . . . . 10.0 108.671 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.05 -178.08 5.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 10.0 111.979 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 4.3 t -152.39 142.02 21.83 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.192 -0.67 . . . . 10.0 109.192 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.744 ' HB2' HD23 ' B' ' 19' ' ' LEU . . . -73.24 -18.58 61.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.825 0.345 . . . . 10.0 110.999 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 30.9 tttm -72.03 -47.32 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.37 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.33 -47.08 18.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.675 179.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . . . . . . . . . 14.4 ttt-85 68.2 25.86 7.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.635 -0.711 . . . . 10.0 111.765 179.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -110.01 117.14 32.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.044 0.45 . . . . 10.0 110.982 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 102.46 13.19 31.14 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.894 -0.67 . . . . 10.0 112.352 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t -100.05 -32.64 3.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.185 0.517 . . . . 10.0 110.853 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -61.58 -55.45 30.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 10.0 111.833 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . 0.705 ' HA ' ' HD2' ' B' ' 157' ' ' TYR . 9.4 t70 -72.33 -15.17 61.88 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.463 0.542 . . . . 10.0 112.463 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.59 -38.49 84.82 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.68 -0.489 . . . . 10.0 109.68 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -69.42 -40.35 77.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.879 -0.6 . . . . 10.0 109.875 178.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' B' ' 154' ' ' ASP . 90.3 m-85 -63.47 -42.13 98.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.029 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -59.18 -42.75 91.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.009 178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . 0.445 ' O ' HG13 ' B' ' 163' ' ' ILE . 25.5 tp -61.29 -40.93 95.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.202 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.655 HG21 HG21 ' B' ' 46' ' ' ILE . 82.9 t -65.23 -38.27 82.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.036 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 -66.69 -34.3 77.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.926 -0.579 . . . . 10.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -64.29 -44.86 90.34 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.78 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 159' ' ' LEU . 43.3 mt -56.18 -43.26 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.965 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.44 -43.3 96.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 10.0 111.13 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . 0.567 ' HD2' ' H63' ' D' ' 507' ' ' PCW . 51.6 mtmt -73.38 -31.51 63.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.016 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -63.52 -51.77 64.04 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.131 -0.486 . . . . 10.0 111.462 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -70.0 -36.2 74.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.055 0.455 . . . . 10.0 111.454 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.4 ' OE2' ' H82' ' D' ' 504' ' ' PCW . 29.1 tt0 -64.77 -38.86 92.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.967 -0.561 . . . . 10.0 109.702 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.677 ' HG3' ' H82' ' B' ' 202' ' ' PCW . 38.4 ttpt -55.48 -43.47 75.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.462 -0.79 . . . . 10.0 110.83 179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 2.2 mmt -68.09 -46.29 71.4 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.714 -0.675 . . . . 10.0 111.566 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 14.0 m -65.04 -37.45 87.64 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.287 0.477 . . . . 10.0 112.287 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.908 ' HB3' ' H1 ' ' A' ' 409' ' ' 17F . 41.2 mtmt -67.59 -38.32 83.84 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.428 -0.351 . . . . 10.0 111.629 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -77.28 -55.54 5.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.363 -0.38 . . . . 10.0 110.725 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 80.8 -114.12 3.77 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.964 -0.636 . . . . 10.0 113.098 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -112.92 -160.89 0.73 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.817 0.341 . . . . 10.0 110.682 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.26 143.29 48.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.213 0.53 . . . . 10.0 111.745 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -159.21 141.99 14.18 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.16 -179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . 0.43 ' HE3' ' HB3' ' B' ' 178' ' ' LYS . 18.6 ttpp -71.09 102.54 2.5 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.973 -0.751 . . . . 10.0 108.973 178.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -132.67 101.18 5.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.715 -0.22 . . . . 10.0 110.62 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -63.16 102.24 0.36 Allowed 'General case' 0 C--N 1.329 -0.313 0 O-C-N 123.791 0.682 . . . . 10.0 109.958 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 10.0 m -106.85 106.72 17.38 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.59 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.411 ' HE2' ' HB3' ' B' ' 182' ' ' LYS . 31.7 ttpt -149.38 131.2 15.11 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.762 -0.654 . . . . 10.0 110.153 -179.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 7.0 t -97.54 153.46 18.15 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.204 -0.665 . . . . 10.0 109.204 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.554 ' HD3' ' C28' ' A' ' 411' ' ' PCW . 4.6 mmtp 63.93 -151.24 0.31 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.295 0.372 . . . . 10.0 111.18 -178.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.492 ' H ' ' HB3' ' B' ' 184' ' ' LYS . 21.5 t . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 120.836 0.351 . . . . 10.0 111.005 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 . . . . . 0 C--O 1.234 0.268 0 CA-C-O 120.538 0.209 . . . . 10.0 110.591 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -143.93 128.67 18.27 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.885 0.374 . . . . 10.0 111.426 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . . . . . . . . . 3.5 tp -123.11 126.89 74.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.23 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.502 ' HD2' ' HG2' ' D' ' 425' ' ' GLU . 40.3 ttm180 -96.93 106.52 18.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.217 -0.447 . . . . 10.0 110.902 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 26.0 t -90.22 121.72 40.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.254 179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -102.95 127.13 50.29 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.926 -0.579 . . . . 10.0 111.482 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . 0.506 ' HB3' ' HD2' ' D' ' 363' ' ' PRO . 7.1 mp -99.61 168.19 9.94 Favored Pre-proline 0 C--N 1.32 -0.68 0 N-CA-C 108.598 -0.89 . . . . 10.0 108.598 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . 0.506 ' HD2' ' HB3' ' D' ' 362' ' ' LEU . 12.4 Cg_endo -55.11 147.2 55.04 Favored 'Trans proline' 0 C--O 1.239 0.557 0 C-N-CA 122.726 2.284 . . . . 10.0 113.566 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 45.7 t30 72.58 -101.05 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.169 -0.923 . . . . 10.0 113.16 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -137.04 18.97 2.99 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 112.474 0.546 . . . . 10.0 112.474 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . 0.471 ' HB3' ' HB2' ' D' ' 362' ' ' LEU . 6.4 tt0 -85.42 139.1 31.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 7.5 ptt85 -141.12 139.74 34.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.783 0.325 . . . . 10.0 111.538 -179.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' B' ' 37' ' ' GLU . 13.1 m -139.31 114.34 9.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.91 -0.587 . . . . 10.0 110.377 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' B' ' 37' ' ' GLU . 14.7 t -92.72 122.6 44.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.986 -0.375 . . . . 10.0 109.986 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 15.8 m -122.08 169.33 13.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.262 -0.427 . . . . 10.0 110.548 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.676 ' HB2' HD11 ' B' ' 36' ' ' ILE . 8.9 t-20 -125.15 120.13 30.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.303 -0.408 . . . . 10.0 110.184 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 20.5 m -96.67 145.77 8.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.871 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -144.98 153.23 41.29 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.577 -0.283 . . . . 10.0 110.845 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 68.37 -89.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 O-C-N 123.962 0.788 . . . . 10.0 112.09 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -153.7 88.6 0.13 Allowed Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 111.222 -0.751 . . . . 10.0 111.222 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.3 mtt -119.22 129.21 54.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.843 0.354 . . . . 10.0 111.17 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.14 168.08 11.88 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.334 -0.617 . . . . 10.0 109.334 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.681 HD21 HD12 ' D' ' 421' ' ' LEU . 45.0 mt -54.01 -50.0 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.89 0.376 . . . . 10.0 111.376 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . 0.524 ' HB2' ' HB3' ' D' ' 414' ' ' TRP . 54.4 t-80 -57.9 -37.94 74.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.812 -0.631 . . . . 10.0 111.226 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -61.59 -49.41 76.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.933 -0.576 . . . . 10.0 111.869 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.48 -28.94 61.23 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.396 0.517 . . . . 10.0 112.396 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 91.7 mt -71.87 -26.75 62.48 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.234 0.54 . . . . 10.0 110.993 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 41.5 ttp -62.22 -22.82 66.25 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.452 -0.795 . . . . 10.0 111.512 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -68.49 -53.45 23.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.683 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -72.23 -25.51 61.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.057 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 19.1 tp -56.09 -42.46 76.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.723 -0.672 . . . . 10.0 111.702 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -78.03 -23.18 48.31 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.851 0.315 . . . . 10.0 111.851 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.515 HG13 HD13 ' B' ' 21' ' ' ILE . 70.7 t -79.11 -49.45 19.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.96 0.41 . . . . 10.0 110.409 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . . . . . . . . . 13.7 mmt180 -78.07 -30.57 49.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.947 -0.569 . . . . 10.0 111.809 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 68.98 67.82 1.83 Allowed Glycine 0 CA--C 1.517 0.205 0 C-N-CA 120.87 -0.681 . . . . 10.0 113.054 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . 0.471 ' CD2' ' HZ ' ' D' ' 430' ' ' PHE . 1.8 mp -136.34 175.59 9.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.593 0.235 . . . . 10.0 110.824 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -108.14 127.31 27.83 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 10.0 111.586 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.32 -13.55 28.07 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.399 . . . . 10.0 112.159 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.99 -24.52 67.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . . . . . . . . . 60.6 m -105.23 5.85 32.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.988 0.423 . . . . 10.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 35.8 m -113.81 152.46 30.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.868 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -133.81 142.24 47.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.045 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.5 m -86.4 122.8 39.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.025 0.44 . . . . 10.0 111.55 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -119.78 131.88 55.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.077 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.567 ' HB3' HD12 ' D' ' 412' ' ' LEU . 12.2 ptm180 -92.31 -173.05 3.29 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.529 -0.305 . . . . 10.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 23.0 tp -65.0 140.14 58.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.597 0.237 . . . . 10.0 110.871 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' D' ' 409' ' ' LYS . 11.1 mp -79.25 64.26 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.014 0.435 . . . . 10.0 110.653 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -64.89 110.7 2.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.947 -0.57 . . . . 10.0 112.23 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 52.83 41.88 31.83 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.33 -0.85 . . . . 10.0 112.447 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . 0.454 ' CE1' ' HB3' ' D' ' 408' ' ' LYS . 20.4 t-80 -104.74 154.81 19.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.613 -0.267 . . . . 10.0 110.331 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -62.18 -47.82 82.82 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.296 0.373 . . . . 10.0 110.699 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 164.88 40.53 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.632 -0.794 . . . . 10.0 113.029 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . 0.454 ' HB3' ' CE1' ' D' ' 405' ' ' HIS . 19.1 ttpp -134.85 138.13 43.9 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.7 0.285 . . . . 10.0 110.316 179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . 0.748 ' HA ' HD11 ' D' ' 402' ' ' LEU . 7.1 pttt -64.14 137.35 57.92 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.093 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.77 114.53 26.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 411' ' ' ARG . 37.5 ttp180 -73.15 140.13 46.85 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.028 -0.533 . . . . 10.0 111.533 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . 0.567 HD12 ' HB3' ' D' ' 400' ' ' ARG . 1.0 OUTLIER -119.21 -153.69 0.55 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.829 -0.623 . . . . 10.0 110.431 -179.723 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . 0.448 ' O ' HD12 ' D' ' 378' ' ' LEU . 6.5 t70 -118.69 160.63 21.5 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.402 -0.592 . . . . 10.0 109.402 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . 0.524 ' HB3' ' HB2' ' D' ' 379' ' ' HIS . 47.5 m95 -87.43 -19.9 27.4 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.855 0.359 . . . . 10.0 111.125 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -87.75 -4.26 58.91 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.95 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . . . . . . . . . 14.6 m -60.65 134.34 56.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.011 -0.54 . . . . 10.0 110.805 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -70.26 140.19 52.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.703 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -71.44 -26.09 62.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.995 -0.548 . . . . 10.0 111.458 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.07 62.72 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.232 0.539 . . . . 10.0 110.843 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 1.5 m -77.04 -5.64 49.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.481 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . 0.681 HD12 HD21 ' D' ' 378' ' ' LEU . 93.0 mt -125.07 27.17 6.76 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.958 -0.564 . . . . 10.0 110.367 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.52 124.5 19.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.999 -0.546 . . . . 10.0 111.286 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 89.98 -1.13 80.1 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.9 -0.667 . . . . 10.0 112.221 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' D' ' 400' ' ' ARG . 15.5 tt0 -101.37 172.6 6.88 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.795 -0.446 . . . . 10.0 109.795 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.502 ' HG2' ' HD2' ' D' ' 359' ' ' ARG . 21.2 mt-10 -120.78 112.35 18.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.114 0.483 . . . . 10.0 110.432 179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.555 HD22 HD22 ' D' ' 378' ' ' LEU . 17.4 tp -91.4 127.1 36.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.015 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -107.46 129.93 54.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.449 -0.341 . . . . 10.0 110.11 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 3.0 t -109.77 75.19 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.085 0.469 . . . . 10.0 109.947 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -89.92 164.05 14.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 10.0 111.119 -178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . 0.471 ' HZ ' ' CD2' ' D' ' 391' ' ' LEU . 34.4 m-85 -84.75 148.49 26.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.614 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 3.3 pp -77.52 -16.21 58.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.112 0.482 . . . . 10.0 110.097 178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -120.87 128.61 52.97 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.893 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -124.55 110.69 14.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.973 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 61.7 t -112.32 113.65 51.18 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.84 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -86.19 177.89 4.33 Favored 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.823 2.349 . . . . 10.0 111.692 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' D' ' 436' ' ' LEU . 3.9 mm? 64.12 91.87 0.07 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.037 -0.529 . . . . 10.0 111.826 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.39 144.84 26.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.745 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.81 -174.62 2.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.634 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . 0.446 ' CE1' ' HB3' ' D' ' 465' ' ' CYS . 50.5 t60 -85.34 127.6 34.4 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 10.0 109.979 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -89.57 111.75 22.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.819 -0.628 . . . . 10.0 110.199 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . 0.515 ' HZ ' ' HB3' ' D' ' 477' ' ' SER . 2.2 m-85 -80.99 122.03 26.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.508 -0.314 . . . . 10.0 110.927 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -137.16 124.23 21.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.406 -0.361 . . . . 10.0 110.808 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' D' ' 443' ' ' ARG . 4.6 ptm180 -89.72 38.86 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.236 -0.438 . . . . 10.0 111.133 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' D' ' 444' ' ' LYS . 17.4 ptmt -88.27 163.29 16.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.12 -0.491 . . . . 10.0 110.572 -179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 2.5 p -78.33 166.2 22.95 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.011 0.434 . . . . 10.0 111.148 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -92.5 172.75 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.956 -0.566 . . . . 10.0 111.56 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 22.5 mt -81.19 -31.41 34.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.867 -0.606 . . . . 10.0 111.039 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 56.9 tttt -155.87 152.67 28.62 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.626 -0.879 . . . . 10.0 108.626 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 15.6 tp -72.05 90.58 1.19 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 10.0 110.608 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . . . . . . . . . . . -102.08 -172.87 2.22 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.009 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 458' ' ' PHE . 59.7 m-85 -100.39 165.62 11.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.619 0.247 . . . . 10.0 110.384 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . 0.614 ' HA ' HD23 ' D' ' 459' ' ' LEU . 47.6 t -75.1 156.18 36.31 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.957 -0.757 . . . . 10.0 108.957 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -104.44 -0.76 27.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.248 0.547 . . . . 10.0 110.039 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' D' ' 476' ' ' CYS . 18.2 mm -111.79 -42.92 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.714 -0.675 . . . . 10.0 110.623 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 2.8 m -101.8 -178.47 3.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.427 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . 0.618 ' HB3' ' C7 ' ' D' ' 508' ' ' PCW . 55.2 mt-30 -105.88 28.98 7.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.359 0.599 . . . . 10.0 110.107 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 3.2 mptp? -121.31 175.31 6.21 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.29 -0.868 . . . . 10.0 110.282 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . 0.536 ' HA ' ' HA ' ' D' ' 451' ' ' PHE . 2.9 p90 -80.43 157.71 26.15 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.024 0.44 . . . . 10.0 111.237 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' D' ' 452' ' ' CYS . 0.2 OUTLIER -99.14 111.85 24.14 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.403 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.487 ' HB2' ' H ' ' D' ' 461' ' ' ASN . 0.3 OUTLIER -97.8 -127.05 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.574 -0.528 . . . . 10.0 109.574 179.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.487 ' H ' ' HB2' ' D' ' 460' ' ' LEU . 6.7 p-10 -76.2 63.94 1.94 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.744 0.783 . . . . 10.0 110.094 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -94.54 -148.84 24.68 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.601 -0.727 . . . . 10.0 112.05 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . 0.464 ' CE2' ' HG2' ' D' ' 474' ' ' GLU . 54.4 m-85 -128.21 142.38 51.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.375 0.607 . . . . 10.0 111.475 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . 0.55 HH22 HG12 ' B' ' 44' ' ' VAL . 9.5 ptm180 -129.3 141.79 51.01 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.361 -0.836 . . . . 10.0 108.816 178.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.446 ' HB3' ' CE1' ' D' ' 439' ' ' HIS . 0.1 OUTLIER -91.65 141.86 28.24 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 113.224 0.824 . . . . 10.0 113.224 -178.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -90.33 -20.82 22.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.072 -1.084 . . . . 10.0 108.072 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . . . . . . . . . 3.1 p -88.99 -15.17 34.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.823 -1.081 . . . . 10.0 110.465 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . 0.427 ' HB3' ' HB2' ' D' ' 484' ' ' CYS . 0.0 OUTLIER -132.83 -80.28 0.49 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.511 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 119.56 48.17 0.35 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.87 -0.681 . . . . 10.0 112.496 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -101.14 177.97 4.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.784 0.326 . . . . 10.0 111.622 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 13.4 mttp -126.44 110.51 13.4 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 109.164 -0.68 . . . . 10.0 109.164 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.721 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 42.4 p90 -148.59 161.21 42.15 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 112.339 0.496 . . . . 10.0 112.339 -179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . 0.404 ' CE1' ' HB2' ' D' ' 452' ' ' CYS . 51.3 m80 -93.44 -171.44 2.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.667 -0.697 . . . . 10.0 110.422 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . 0.464 ' HG2' ' CE2' ' D' ' 463' ' ' PHE . 38.9 mt-10 -71.92 -33.86 68.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.941 -0.572 . . . . 10.0 110.599 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' D' ' 479' ' ' LYS . 50.5 m80 -81.79 -23.39 36.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 10.0 111.159 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.721 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 34.9 m -70.04 -26.48 64.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.139 -0.482 . . . . 10.0 111.897 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . 0.515 ' HB3' ' HZ ' ' D' ' 441' ' ' PHE . 0.8 OUTLIER -55.42 -38.11 68.54 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 10.0 111.495 -179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.1 p -106.78 11.19 30.43 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.405 0.622 . . . . 10.0 110.104 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . 0.481 ' HB3' ' HA ' ' D' ' 476' ' ' CYS . 36.4 tttm -100.28 -47.84 4.8 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.412 -0.813 . . . . 10.0 110.905 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.486 ' HA ' ' HD3' ' D' ' 481' ' ' PRO . 7.8 p -76.44 118.93 74.96 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-O 121.083 0.468 . . . . 10.0 111.479 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' D' ' 480' ' ' VAL . 10.0 Cg_exo -73.06 -45.48 0.45 Allowed 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.14 2.56 . . . . 10.0 112.205 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.86 139.66 43.34 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.781 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 25.8 tpp -87.63 153.5 21.33 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.927 -0.398 . . . . 10.0 109.927 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . 0.427 ' HB2' ' HB3' ' D' ' 468' ' ' CYS . 0.1 OUTLIER -79.11 29.32 0.22 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -179.323 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 21.9 t -89.93 110.7 22.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -109.57 156.09 20.6 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.96 -0.563 . . . . 10.0 110.629 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 5.2 p90 . . . . . 0 C--N 1.323 -0.582 0 CA-C-N 116.171 -0.468 . . . . 10.0 110.67 -179.786 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.021 H182 H221 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 1.087 ' H62' ' H18' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.03 H132 H121 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 1.021 ' H12' H381 ' B' ' 210' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.164 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.903 H221 H481 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.014 H132 H341 ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.011 H172 ' H20' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.127 ' H42' ' C18' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.983 ' H71' H252 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.033 H141 ' C33' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 1.032 ' C1 ' H372 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.111 H411 ' C37' ' A' ' 413' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 0.925 H482 H472 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.033 ' C33' H141 ' A' ' 411' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.01 H122 ' C9 ' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.046 H451 ' H77' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 0.943 H461 H421 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 1.12 H462 ' H64' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 0.983 ' H2 ' ' C4 ' ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 1.019 H381 ' H40' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 1.049 H211 H382 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.072 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 0.896 ' H19' ' H50' ' C' ' 629' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 1.03 ' O31' ' H61' ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 1.002 ' H62' ' O1 ' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 1.052 ' H41' H342 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.031 H212 ' C17' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.049 H382 H211 ' C' ' 605' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 0.954 H421 H461 ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 1.037 H161 H11A ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.033 ' H39' H161 ' C' ' 617' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.024 H411 ' H11' ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 1.033 H161 ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 1.016 H382 H121 ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 1.028 H121 ' H4A' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.053 H141 ' H6 ' ' B' ' 215' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.046 ' H82' ' H20' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.052 H342 ' H41' ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 0.977 ' H19' H151 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.032 H372 ' C1 ' ' A' ' 412' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.073 ' C4 ' ' H2 ' ' C' ' 625' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.12 ' H64' H462 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.143 H18A ' O7 ' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.992 ' H59' H12A ' C' ' 628' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 0.932 ' H78' ' H40' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.01 ' C9 ' H122 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.002 ' O1 ' ' H62' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.037 H11A H161 ' C' ' 614' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.03 H121 H132 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.069 H332 ' H11' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 0.899 H372 H361 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.088 H482 ' H38' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.02 ' H39' H483 ' B' ' 201' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.019 H142 ' H18' ' B' ' 213' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 0.963 H431 H211 ' B' ' 205' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.042 H121 ' C18' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 0.941 H242 H181 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 1.021 H381 ' H12' ' A' ' 404' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.055 H121 H371 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.061 H351 ' C20' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.05 ' H29' H372 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 1.042 ' C18' H121 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.053 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.489 ' PG ' ' HE1' ' B' ' 32' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.036 H171 H332 ' D' ' 502' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.036 H332 H171 ' D' ' 501' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.001 H251 H211 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 1.022 H331 ' O1 ' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.06 H171 H132 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.025 H272 H441 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.069 ' H11' H332 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.261 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.076 H242 ' H43' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 0.996 H261 H462 ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.127 ' C18' ' H42' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.042 H19A ' H19' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.087 ' H18' ' H62' ' A' ' 402' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.088 ' H38' H482 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.031 H211 H451 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 1.012 ' H73' ' H82' ' D' ' 515' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.753 0.311 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -64.29 -60.67 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.245 -0.434 . . . . 10.0 111.209 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' LEU . . . . . 0.72 HD21 H282 ' A' ' 415' ' ' PCW . 24.1 mt -67.69 -33.03 74.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.41 -0.359 . . . . 10.0 110.644 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' LEU . . . . . . . . . . . . . 89.4 mt -61.74 -41.36 97.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -67.35 -47.98 68.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -60.65 -34.26 74.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 10.0 110.175 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' TRP . . . . . . . . . . . . . 32.0 t90 -63.1 -42.12 99.53 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.489 -0.778 . . . . 10.0 110.786 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -65.37 -36.55 84.34 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.657 0.265 . . . . 10.0 110.828 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 1.1 m -60.13 -43.27 95.79 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.277 0.561 . . . . 10.0 109.683 179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.07 -44.43 84.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.739 -0.664 . . . . 10.0 109.961 179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' THR . . . . . . . . . . . . . 26.2 m -59.14 -46.22 88.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 10.0 110.981 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' SER . . . . . . . . . . . . . 52.5 m -63.36 -37.58 87.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.968 0.413 . . . . 10.0 110.204 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' THR . . . . . 0.584 ' O ' ' HG ' ' A' ' 217' ' ' LEU . 87.5 m -66.1 -48.74 69.93 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.607 -0.516 . . . . 10.0 109.607 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' PHE . . . . . 0.678 ' HD2' H282 ' A' ' 413' ' ' PCW . 0.5 OUTLIER -58.94 -36.22 74.42 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.702 -0.681 . . . . 10.0 110.501 179.661 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 219' ' ' GLU . 49.0 m -64.58 -49.87 69.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.412 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' LYS . . . . . . . . . . . . . 45.2 mttt -64.65 -32.22 73.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 10.0 110.509 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 213' ' ' THR . 51.6 mt -64.84 -40.56 95.37 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.914 -0.773 . . . . 10.0 108.914 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -65.06 -36.14 83.39 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.43 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 215' ' ' SER . 30.5 mt-10 -67.51 -36.64 81.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.858 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -77.35 -35.1 54.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.101 179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 217' ' ' LEU . 33.1 mt -55.84 -35.73 66.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 10.0 111.187 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . -53.73 -70.41 0.94 Allowed Glycine 0 C--N 1.333 0.408 0 C-N-CA 121.087 -0.577 . . . . 10.0 111.751 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 223' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.15 -42.11 72.05 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.425 2.083 . . . . 10.0 111.081 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 224' ' ' VAL . . . . . . . . . . . . . 21.4 t -54.9 -51.61 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.81 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 225' ' ' THR . . . . . . . . . . . . . 13.5 p -62.93 -35.95 81.78 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.54 -0.464 . . . . 10.0 111.127 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 226' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -67.92 -52.07 40.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.07 -0.514 . . . . 10.0 110.549 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 227' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -60.11 -41.39 92.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.4 0.619 . . . . 10.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 228' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -65.96 -46.72 77.1 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.843 -0.617 . . . . 10.0 111.264 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 229' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -65.63 -31.82 73.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.866 0.365 . . . . 10.0 110.473 179.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.96 -48.82 74.96 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.555 -0.535 . . . . 10.0 109.555 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 231' ' ' ASN . . . . . 0.572 ' HA ' ' HD2' ' A' ' 234' ' ' LYS . 66.7 m-20 -69.55 -35.41 75.39 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.04 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 232' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.36 -40.32 96.04 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.828 -0.623 . . . . 10.0 109.707 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 233' ' ' GLU . . . . . 0.622 ' HA ' ' OG1' ' A' ' 236' ' ' THR . 10.0 mm-40 -67.66 -25.43 65.71 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.3 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 234' ' ' LYS . . . . . 0.572 ' HD2' ' HA ' ' A' ' 231' ' ' ASN . 70.1 mttt -73.67 -40.74 63.47 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.064 -1.087 . . . . 10.0 108.064 177.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 235' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -69.51 -42.88 74.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.202 -0.908 . . . . 10.0 110.141 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 236' ' ' THR . . . . . 0.622 ' OG1' ' HA ' ' A' ' 233' ' ' GLU . 17.3 p -67.03 -36.66 82.6 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 110.143 -0.317 . . . . 10.0 110.143 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 237' ' ' GLU . . . . . 0.576 ' HA ' ' HD2' ' A' ' 240' ' ' ARG . 37.2 tt0 -64.62 -44.17 91.39 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.5 -0.926 . . . . 10.0 108.5 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 238' ' ' GLY . . . . . . . . . . . . . . . -60.19 -44.47 97.37 Favored Glycine 0 N--CA 1.44 -1.07 0 N-CA-C 109.296 -1.521 . . . . 10.0 109.296 177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 239' ' ' LEU . . . . . 0.493 ' HA ' ' HB2' ' A' ' 242' ' ' GLU . 70.3 mt -64.51 -28.64 69.79 Favored 'General case' 0 C--O 1.225 -0.222 0 O-C-N 123.61 0.241 . . . . 10.0 111.214 178.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 240' ' ' ARG . . . . . 0.576 ' HD2' ' HA ' ' A' ' 237' ' ' GLU . 39.4 mtt180 -68.84 -41.05 79.02 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.647 -0.872 . . . . 10.0 108.647 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 241' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -70.58 -36.76 73.76 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.332 -0.988 . . . . 10.0 108.332 177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 242' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 239' ' ' LEU . 2.0 mt-10 -65.26 -34.4 78.27 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.185 -0.916 . . . . 10.0 109.886 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 243' ' ' MET . . . . . 0.683 ' HG3' HD12 ' A' ' 247' ' ' LEU . 49.8 ttm -64.67 -29.17 70.16 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.712 -0.847 . . . . 10.0 108.712 177.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 244' ' ' SER . . . . . . . . . . . . . 5.4 m -81.54 8.63 9.12 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.052 -0.976 . . . . 10.0 110.032 178.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 245' ' ' LYS . . . . . . . . . . . . . 57.8 mttm -126.93 -58.34 1.3 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.66 -0.867 . . . . 10.0 108.66 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 246' ' ' ASP . . . . . 0.708 ' HA ' ' NH1' ' C' ' 528' ' ' ARG . 3.9 m-20 -55.84 -66.94 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.326 -179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 247' ' ' LEU . . . . . 0.683 HD12 ' HG3' ' A' ' 243' ' ' MET . 91.8 mt -70.38 -38.23 74.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.338 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 248' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.78 -55.96 26.86 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.766 0.284 . . . . 10.0 111.766 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 249' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -67.38 -34.54 77.49 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.018 -0.273 . . . . 10.0 111.004 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 250' ' ' VAL . . . . . 0.574 ' O ' ' HB ' ' A' ' 254' ' ' VAL . 0.7 OUTLIER -67.35 -26.36 35.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 C-N-CA 120.68 -0.408 . . . . 10.0 110.707 179.274 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 251' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -75.56 -49.01 19.88 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 109.677 -0.49 . . . . 10.0 109.677 178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 252' ' ' ALA . . . . . . . . . . . . . . . -62.09 -42.53 99.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 10.0 110.026 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 253' ' ' LYS . . . . . . . . . . . . . 56.4 mttt -75.88 -22.26 56.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.809 -0.632 . . . . 10.0 111.838 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 254' ' ' VAL . . . . . 0.574 ' HB ' ' O ' ' A' ' 250' ' ' VAL . 0.4 OUTLIER -60.28 -27.63 39.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.991 0.424 . . . . 10.0 110.507 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 255' ' ' GLN . . . . . 0.568 ' HB2' ' HD3' ' A' ' 256' ' ' PRO . 67.1 mt-30 -64.88 -65.92 1.71 Allowed Pre-proline 0 N--CA 1.452 -0.334 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.782 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 256' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 255' ' ' GLN . 39.2 Cg_endo -67.08 -33.33 32.05 Favored 'Trans proline' 0 C--N 1.357 1.004 0 C-N-CA 121.821 1.681 . . . . 10.0 113.165 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 257' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -62.64 -53.86 48.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.753 0.311 . . . . 10.0 110.463 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 258' ' ' LEU . . . . . . . . . . . . . 73.6 mt -73.67 -29.1 62.1 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.455 -0.339 . . . . 10.0 111.315 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 259' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -65.18 -41.83 94.23 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.569 -0.53 . . . . 10.0 109.569 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 260' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -61.52 -44.73 96.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.559 -0.746 . . . . 10.0 109.335 178.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 261' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -66.74 -41.58 87.61 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.581 -0.736 . . . . 10.0 110.229 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -59.24 -49.57 77.33 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.892 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 263' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -62.35 -42.01 99.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 10.0 110.728 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 264' ' ' LYS . . . . . 0.659 ' HE2' ' HB1' ' C' ' 509' ' ' ALA . 45.4 mttt -65.53 -45.16 84.53 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.088 -0.506 . . . . 10.0 110.622 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 265' ' ' TRP . . . . . 0.408 ' O ' ' HG2' ' A' ' 269' ' ' MET . 5.1 m95 -64.67 -33.89 77.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.386 . . . . 10.0 110.168 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 266' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -64.12 -43.95 93.74 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.074 -0.713 . . . . 10.0 109.074 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 267' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.61 -39.27 91.35 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.974 -0.75 . . . . 10.0 108.974 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 268' ' ' GLU . . . . . 0.513 ' OE1' ' HD3' ' C' ' 506' ' ' ARG . 25.4 mt-10 -60.51 -46.55 89.72 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.687 -0.688 . . . . 10.0 109.97 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 269' ' ' MET . . . . . 0.408 ' HG2' ' O ' ' A' ' 265' ' ' TRP . 93.6 mmm -66.68 -40.35 88.52 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.85 -0.614 . . . . 10.0 110.278 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 270' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -59.57 -47.74 84.37 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 10.0 109.63 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 271' ' ' LEU . . . . . . . . . . . . . 95.6 mt -68.06 -32.22 72.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.51 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 272' ' ' TYR . . . . . 0.403 ' O ' ' HB ' ' A' ' 276' ' ' VAL . 0.8 OUTLIER -63.56 -49.44 73.43 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 109.428 -0.582 . . . . 10.0 109.428 178.512 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 273' ' ' ARG . . . . . 0.553 ' HA ' HG12 ' A' ' 276' ' ' VAL . 87.2 mtt180 -70.5 -35.15 73.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.557 -0.747 . . . . 10.0 110.65 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 274' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -60.01 -42.04 93.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.775 -0.648 . . . . 10.0 110.384 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 275' ' ' LYS . . . . . 0.601 ' HG2' HD21 ' C' ' 499' ' ' LEU . 10.0 mptt -86.78 -37.13 18.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.352 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 276' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 273' ' ' ARG . 1.9 p -52.27 -33.44 17.1 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 N-CA-C 113.176 0.806 . . . . 10.0 113.176 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 277' ' ' GLU . . . . . 0.42 ' HB2' ' HD3' ' A' ' 278' ' ' PRO . 7.5 mt-10 -67.75 -63.58 2.5 Favored Pre-proline 0 CA--C 1.537 0.477 0 N-CA-C 111.916 0.339 . . . . 10.0 111.916 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 278' ' ' PRO . . . . . 0.42 ' HD3' ' HB2' ' A' ' 277' ' ' GLU . 19.2 Cg_endo -62.56 -34.13 76.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.734 1.622 . . . . 10.0 111.551 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 279' ' ' LEU . . . . . 0.842 HD22 ' HE3' ' C' ' 495' ' ' LYS . 16.6 mt -67.17 -40.57 86.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.283 -0.266 . . . . 10.0 110.283 179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 280' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 276' ' ' VAL . 34.1 mtt180 -67.83 -29.06 68.12 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.922 -0.399 . . . . 10.0 109.922 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 281' ' ' ALA . . . . . . . . . . . . . . . -69.4 -44.79 70.72 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.476 -0.935 . . . . 10.0 108.476 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -63.51 -44.68 93.59 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.58 -0.736 . . . . 10.0 109.229 178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 283' ' ' LEU . . . . . . . . . . . . . 68.6 mt -62.1 -40.74 96.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.222 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 284' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -65.1 -47.6 76.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.477 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 285' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -64.19 -48.79 74.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.032 -0.531 . . . . 10.0 109.923 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 286' ' ' GLY . . . . . . . . . . . . . . . -59.05 -48.38 86.21 Favored Glycine 0 N--CA 1.45 -0.428 0 CA-C-N 115.735 -0.666 . . . . 10.0 111.667 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 287' ' ' ALA . . . . . . . . . . . . . . . -62.75 -43.6 98.37 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.971 -0.114 . . . . 10.0 110.713 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 288' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 288' ' ' ARG . 42.9 ttm180 -55.84 -47.91 76.43 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.489 0.493 . . . . 10.0 110.972 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 289' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.8 -45.0 84.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.546 -0.297 . . . . 10.0 110.699 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 290' ' ' LYS . . . . . . . . . . . . . 61.0 mttt -63.39 -44.18 95.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.351 -0.386 . . . . 10.0 111.209 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 291' ' ' LEU . . . . . . . . . . . . . 93.7 mt -65.88 -41.13 91.96 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 110.027 -0.361 . . . . 10.0 110.027 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 292' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -62.93 -37.47 87.18 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.227 178.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 293' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -64.05 -42.72 96.94 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.084 -0.71 . . . . 10.0 109.084 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 294' ' ' LEU . . . . . . . . . . . . . 87.2 mt -65.62 -40.01 92.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.827 -0.624 . . . . 10.0 110.141 179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 295' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -61.74 -40.2 94.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.741 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 296' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -68.23 -8.59 40.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.925 -0.58 . . . . 10.0 111.598 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 297' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 297' ' ' LYS . 6.0 mmtp -111.02 -39.58 4.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.348 179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 298' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' A' ' 302' ' ' GLY . 61.0 mt -65.5 -24.51 67.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.865 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 299' ' ' SER . . . . . 0.515 ' HB2' ' HD3' ' A' ' 300' ' ' PRO . 5.4 m -78.95 -65.16 0.32 Allowed Pre-proline 0 CA--C 1.536 0.428 0 N-CA-C 113.025 0.75 . . . . 10.0 113.025 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 300' ' ' PRO . . . . . 0.515 ' HD3' ' HB2' ' A' ' 299' ' ' SER . 37.1 Cg_endo -65.84 -51.56 1.24 Allowed 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.914 1.743 . . . . 10.0 112.227 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 301' ' ' LEU . . . . . 0.489 HD13 ' HG2' ' C' ' 473' ' ' LYS . 77.6 mt -67.89 -27.62 66.81 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.718 0.295 . . . . 10.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 302' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' A' ' 298' ' ' LEU . . . -69.62 -49.23 38.34 Favored Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.957 -0.857 . . . . 10.0 110.957 178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 303' ' ' GLU . . . . . 0.435 ' HG2' ' NH1' ' A' ' 306' ' ' ARG . 22.3 mt-10 -65.89 -35.95 82.05 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.826 -0.435 . . . . 10.0 109.826 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 304' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.19 -42.35 99.34 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.485 -0.931 . . . . 10.0 108.485 177.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 305' ' ' MET . . . . . . . . . . . . . 10.9 tpt -64.55 -36.45 84.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.604 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 306' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 310' ' ' ARG . 80.4 mtt180 -63.52 -44.89 92.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.354 -0.61 . . . . 10.0 109.354 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 307' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -67.15 -39.79 86.57 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.589 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 308' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -64.03 -37.66 88.25 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 177.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 309' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 312' ' ' HIS . . . -64.49 -38.31 90.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.452 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 310' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 306' ' ' ARG . 67.3 mtt180 -57.73 -50.95 71.5 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 109.312 -0.625 . . . . 10.0 109.312 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 311' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.65 75.96 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.589 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 312' ' ' HIS . . . . . 0.401 ' HB2' ' HA ' ' A' ' 309' ' ' ALA . 1.2 m-70 -59.77 -48.95 79.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.926 -0.768 . . . . 10.0 108.926 178.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 313' ' ' VAL . . . . . . . . . . . . . 85.6 t -72.32 -32.96 44.52 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 CA-C-N 115.291 -0.868 . . . . 10.0 109.924 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 314' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -61.9 -48.87 78.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.271 0.558 . . . . 10.0 109.895 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 315' ' ' ALA . . . . . . . . . . . . . . . -60.48 -38.54 84.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 10.0 110.026 179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 316' ' ' LEU . . . . . . . . . . . . . 37.4 mt -72.59 -38.55 67.84 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.022 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 317' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 317' ' ' ARG . 25.0 ttm105 -62.86 -41.45 99.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.119 0.485 . . . . 10.0 110.105 179.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 318' ' ' THR . . . . . . . . . . . . . 7.8 m -72.14 -24.74 61.5 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.972 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 319' ' ' HIS . . . . . . . . . . . . . 7.9 m80 -86.6 -44.41 11.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.174 -0.466 . . . . 10.0 110.666 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 320' ' ' LEU . . . . . . . . . . . . . 78.3 mt -63.76 -31.32 72.45 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.616 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 321' ' ' ALA . . . . . 0.468 ' HB3' ' HD3' ' A' ' 322' ' ' PRO . . . -52.18 -64.31 1.61 Allowed Pre-proline 0 N--CA 1.467 0.389 0 N-CA-C 112.245 0.461 . . . . 10.0 112.245 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 322' ' ' PRO . . . . . 0.468 ' HD3' ' HB3' ' A' ' 321' ' ' ALA . 51.5 Cg_endo -70.67 -32.22 15.18 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 121.458 1.439 . . . . 10.0 111.278 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 323' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -60.51 -49.9 75.7 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.441 -0.345 . . . . 10.0 111.36 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 324' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 328' ' ' ARG . 49.4 p -67.17 -36.86 82.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.63 0.252 . . . . 10.0 110.792 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 325' ' ' ASP . . . . . 0.609 ' HA ' ' HD2' ' A' ' 328' ' ' ARG . 17.2 t0 -65.4 -40.76 93.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.251 0.548 . . . . 10.0 110.208 179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 326' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -73.56 -28.48 61.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.532 -0.544 . . . . 10.0 109.532 178.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 327' ' ' LEU . . . . . 0.816 HD11 H241 ' C' ' 601' ' ' PCW . 17.2 mt -65.32 -35.63 81.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 108.698 -0.853 . . . . 10.0 108.698 177.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 328' ' ' ARG . . . . . 0.609 ' HD2' ' HA ' ' A' ' 325' ' ' ASP . 85.7 mtt180 -62.99 -36.15 82.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.412 -0.813 . . . . 10.0 108.866 178.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 329' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -67.95 -43.18 79.68 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.446 -0.797 . . . . 10.0 108.867 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 330' ' ' ARG . . . . . . . . . . . . . 6.0 mtt-85 -61.29 -44.27 97.5 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.245 -0.889 . . . . 10.0 109.809 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 331' ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.8 -45.91 90.44 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.561 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 332' ' ' ALA . . . . . 0.448 ' O ' ' HG3' ' A' ' 336' ' ' GLU . . . -61.78 -46.52 89.2 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.381 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 333' ' ' ALA . . . . . . . . . . . . . . . -59.28 -45.92 89.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.754 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 334' ' ' ARG . . . . . . . . . . . . . 76.7 mtt180 -65.55 -44.55 86.46 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.364 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 335' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 339' ' ' LYS . 37.5 mt -61.96 -42.1 98.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.549 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 336' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 332' ' ' ALA . 21.1 mt-10 -64.91 -40.68 95.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.56 -0.291 . . . . 10.0 110.934 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 337' ' ' ALA . . . . . . . . . . . . . . . -65.56 -45.44 83.33 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.038 -0.727 . . . . 10.0 109.038 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 338' ' ' LEU . . . . . . . . . . . . . 78.5 mt -66.51 -18.34 65.31 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.441 -0.8 . . . . 10.0 111.835 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 339' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 335' ' ' LEU . 66.2 mttt -75.21 -56.48 4.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 340' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.06 -48.52 73.49 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.055 -0.52 . . . . 10.0 110.697 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 341' ' ' ASN . . . . . 0.402 ' O ' ' HG3' ' A' ' 345' ' ' ARG . 26.8 t-20 -66.62 -36.19 81.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.191 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 342' ' ' GLY . . . . . . . . . . . . . . . -67.11 -48.28 60.43 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-N 115.811 -0.631 . . . . 10.0 112.046 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 343' ' ' GLY . . . . . . . . . . . . . . . -58.04 -42.48 95.03 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.556 -0.617 . . . . 10.0 111.556 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 344' ' ' ALA . . . . . . . . . . . . . . . -64.78 -44.16 90.89 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.81 -0.441 . . . . 10.0 109.81 179.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 345' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 341' ' ' ASN . 67.2 mtm180 -64.11 -37.43 87.41 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.99 -0.55 . . . . 10.0 110.573 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 346' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.75 -46.48 85.14 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.178 -0.675 . . . . 10.0 109.178 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 347' ' ' ALA . . . . . . . . . . . . . . . -59.83 -41.71 91.95 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.012 -0.736 . . . . 10.0 109.012 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 348' ' ' GLU . . . . . 0.505 ' OE1' ' HB2' ' C' ' 429' ' ' ASN . 25.2 mt-10 -62.51 -43.45 98.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.943 178.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 349' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.85 -43.77 94.46 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.081 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 350' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.09 -44.21 89.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.141 -0.481 . . . . 10.0 109.918 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 351' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.64 76.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.165 0.507 . . . . 10.0 109.852 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 352' ' ' LYS . . . . . 0.406 ' HG3' ' OE2' ' C' ' 425' ' ' GLU . 15.6 mtmm -61.15 -44.35 97.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.629 . . . . 10.0 110.284 179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 353' ' ' ALA . . . . . . . . . . . . . . . -59.68 -40.27 87.25 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.657 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 354' ' ' THR . . . . . . . . . . . . . 24.4 m -64.49 -39.91 94.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.161 0.505 . . . . 10.0 109.893 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 355' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -70.8 -34.07 71.37 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.862 -0.608 . . . . 10.0 110.652 179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 356' ' ' HIS . . . . . . . . . . . . . 29.7 m-70 -72.96 -28.79 62.62 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.515 -0.55 . . . . 10.0 109.515 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 357' ' ' LEU . . . . . . . . . . . . . 30.7 mt -73.17 -41.37 63.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.09 -0.505 . . . . 10.0 111.023 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.32 -41.4 98.91 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.215 0.531 . . . . 10.0 109.728 179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 359' ' ' THR . . . . . . . . . . . . . 1.8 p -73.82 -30.8 62.91 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 116.096 -0.502 . . . . 10.0 109.895 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 360' ' ' LEU . . . . . . . . . . . . . 50.5 tp -67.73 -29.65 68.93 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 361' ' ' SER . . . . . . . . . . . . . 66.9 m -64.42 -31.99 73.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.277 -0.638 . . . . 10.0 109.277 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 362' ' ' GLU . . . . . 0.423 ' HA ' ' HD2' ' A' ' 366' ' ' PRO . 55.6 mm-40 -68.89 -21.87 64.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.501 0.667 . . . . 10.0 109.644 178.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 363' ' ' LYS . . . . . 0.77 ' HA ' ' HB3' ' A' ' 367' ' ' ALA . 89.7 mttt -92.85 -33.74 14.12 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.691 -0.686 . . . . 10.0 109.77 179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 364' ' ' ALA . . . . . . . . . . . . . . . -77.58 -29.11 51.88 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.797 -0.638 . . . . 10.0 112.394 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.959 ' HB2' ' HD3' ' A' ' 366' ' ' PRO . 70.7 mttt -107.73 -74.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 112.642 0.608 . . . . 10.0 112.642 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 366' ' ' PRO . . . . . 0.959 ' HD3' ' HB2' ' A' ' 365' ' ' LYS . 52.3 Cg_exo -56.56 -57.66 1.31 Allowed 'Trans proline' 0 C--N 1.357 1.009 0 C-N-CA 122.003 1.802 . . . . 10.0 112.963 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 367' ' ' ALA . . . . . 0.77 ' HB3' ' HA ' ' A' ' 363' ' ' LYS . . . -60.92 -51.35 69.66 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.402 0.519 . . . . 10.0 112.402 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' LEU . . . . . 0.502 HD23 ' HA ' ' A' ' 368' ' ' LEU . 9.6 mt -58.83 -46.13 88.42 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.273 0.472 . . . . 10.0 112.273 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -66.06 -40.27 90.79 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 121.196 -0.202 . . . . 10.0 110.526 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.47 -39.66 95.05 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 121.27 0.557 . . . . 10.0 109.713 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' LEU . . . . . . . . . . . . . 43.4 mt -65.63 -45.62 82.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.438 -0.801 . . . . 10.0 109.457 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.578 ' O ' ' HG ' ' A' ' 376' ' ' LEU . 88.6 mtt180 -62.0 -45.69 92.5 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.123 -0.49 . . . . 10.0 110.226 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -60.47 -35.32 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.583 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' GLY . . . . . . . . . . . . . . . -79.44 -30.92 43.23 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.787 -0.642 . . . . 10.0 112.091 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' LEU . . . . . . . . . . . . . 60.1 mt -77.07 -25.01 51.87 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.8 0.296 . . . . 10.0 111.8 179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 372' ' ' ARG . 90.9 mt -52.94 -56.53 22.62 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 112.473 0.546 . . . . 10.0 112.473 179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -68.9 -27.96 30.07 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 121.831 1.687 . . . . 10.0 110.776 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' VAL . . . . . . . . . . . . . 42.6 t -63.11 -45.37 98.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.502 -0.555 . . . . 10.0 109.502 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' LEU . . . . . . . . . . . . . 80.9 mt -62.97 -32.93 74.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.127 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' GLU . . . . . 0.522 ' O ' HG23 ' A' ' 384' ' ' VAL . 7.4 mm-40 -63.46 -50.76 68.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.493 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -40.11 95.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.61 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -62.12 -40.14 94.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.134 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -60.68 -45.93 92.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.52 . . . . 10.0 109.873 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 380' ' ' GLU . 42.5 t -61.87 -44.57 99.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.817 -0.628 . . . . 10.0 109.89 178.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' SER . . . . . . . . . . . . . 17.2 m -61.17 -44.92 96.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 10.0 111.535 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -69.18 -39.53 78.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.728 0.299 . . . . 10.0 111.503 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' LEU . . . . . . . . . . . . . 77.8 mt -63.26 -46.66 85.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.723 0.297 . . . . 10.0 110.975 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' SER . . . . . 0.625 ' HB2' ' HE2' ' C' ' 594' ' ' LYS . 9.8 p -66.79 -41.29 87.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.1 -0.5 . . . . 10.0 110.764 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' ALA . . . . . . . . . . . . . . . -60.61 -40.25 91.15 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.099 0.476 . . . . 10.0 110.461 179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 390' ' ' LEU . 14.7 mt -59.92 -43.12 95.11 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.613 -0.721 . . . . 10.0 109.856 178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.0 -43.75 94.73 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.818 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.73 -45.84 77.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.805 -0.634 . . . . 10.0 111.375 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -61.47 -51.96 66.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.87 -0.605 . . . . 10.0 111.925 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -24.23 65.45 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.192 0.442 . . . . 10.0 112.192 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -78.0 -40.37 39.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.065 0.395 . . . . 10.0 112.065 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.85 -20.04 19.11 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.97 -15.12 17.6 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.778 -0.369 . . . . 10.0 111.838 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.458 -0.337 . . . . 10.0 110.865 -179.895 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 399' ' ' LEU . . . . . . . . . . . . . 2.5 mm? . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.144 0.497 . . . . 10.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 400' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.34 47.58 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.389 0.614 . . . . 10.0 110.876 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 401' ' ' LEU . . . . . . . . . . . . . 87.8 mt -78.42 -30.0 47.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.584 -0.734 . . . . 10.0 110.801 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 402' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.16 -32.43 68.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.269 0.556 . . . . 10.0 109.606 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 403' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.46 -40.67 96.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.3 -0.863 . . . . 10.0 109.226 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 404' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -76.08 -35.24 59.46 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.099 -0.955 . . . . 10.0 109.883 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 405' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -62.11 -34.25 75.98 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.396 -0.82 . . . . 10.0 110.121 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 406' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.23 -48.03 83.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.228 179.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.12 -39.73 91.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.321 -0.399 . . . . 10.0 110.572 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 408' ' ' VAL . . . . . . . . . . . . . 96.7 t -65.58 -46.92 88.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.531 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . . . . . . . . . 6.6 m -66.94 -31.27 71.74 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.565 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 410' ' ' SER . . . . . . . . . . . . . 55.2 m -66.62 -42.12 87.32 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.639 -0.504 . . . . 10.0 109.639 178.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' C' ' 415' ' ' LEU . 0.2 OUTLIER -66.58 -34.12 77.18 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.257 -0.429 . . . . 10.0 109.882 179.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 412' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -64.68 -38.42 90.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.481 -0.563 . . . . 10.0 109.481 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 413' ' ' SER . . . . . . . . . . . . . 22.8 m -68.15 -36.59 79.91 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.756 -0.656 . . . . 10.0 109.252 178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 414' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' C' ' 414' ' ' LYS . 49.3 mmtt -65.93 -32.76 74.44 Favored 'General case' 0 C--O 1.23 0.064 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.057 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 415' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' C' ' 411' ' ' THR . 87.2 mt -66.54 -34.52 78.1 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.965 -0.561 . . . . 10.0 109.655 178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 416' ' ' ARG . . . . . 0.46 HH11 ' HD2' ' C' ' 416' ' ' ARG . 65.4 mtt180 -68.17 -37.27 80.8 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.685 -0.487 . . . . 10.0 109.685 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -66.35 -17.9 65.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.921 -0.582 . . . . 10.0 110.383 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 418' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -96.36 -56.85 2.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.966 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 419' ' ' LEU . . . . . . . . . . . . . 60.7 mt -48.28 -41.38 27.79 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.682 -0.69 . . . . 10.0 112.819 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 420' ' ' GLY . . . . . . . . . . . . . . . -56.34 -74.73 0.3 Allowed Glycine 0 CA--C 1.523 0.539 0 C-N-CA 120.65 -0.786 . . . . 10.0 112.183 179.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 421' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -58.31 -38.14 92.01 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.001 2.467 . . . . 10.0 112.767 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 422' ' ' VAL . . . . . 0.466 ' O ' ' HB2' ' C' ' 426' ' ' PHE . 28.4 t -62.49 -46.11 97.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 112.177 0.436 . . . . 10.0 112.177 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 423' ' ' THR . . . . . . . . . . . . . 68.1 p -69.41 -32.46 71.46 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.274 -0.57 . . . . 10.0 110.685 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 424' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.634 -0.506 . . . . 10.0 109.634 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 425' ' ' GLU . . . . . 0.406 ' OE2' ' HG3' ' A' ' 352' ' ' LYS . 12.5 pt-20 -74.62 -25.43 59.22 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.793 -0.64 . . . . 10.0 110.379 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 426' ' ' PHE . . . . . 0.581 ' O ' ' HG ' ' C' ' 430' ' ' LEU . 15.8 t80 -67.65 -38.41 83.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 108.347 -0.983 . . . . 10.0 108.347 178.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 427' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' C' ' 431' ' ' GLU . 7.3 m0 -67.87 -35.71 79.0 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.373 -0.973 . . . . 10.0 108.373 177.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 428' ' ' ASP . . . . . 0.428 ' O ' ' HG3' ' C' ' 432' ' ' LYS . 37.3 t70 -67.91 -34.07 75.93 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.424 -0.954 . . . . 10.0 108.424 178.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 429' ' ' ASN . . . . . 0.505 ' HB2' ' OE1' ' A' ' 348' ' ' GLU . 1.3 t30 -68.86 -43.96 74.32 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.341 -0.985 . . . . 10.0 108.341 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 430' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' C' ' 426' ' ' PHE . 95.8 mt -62.27 -35.67 79.69 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.502 -0.772 . . . . 10.0 109.122 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 431' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' C' ' 427' ' ' TRP . 65.6 mm-40 -59.84 -47.1 87.08 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.909 -0.587 . . . . 10.0 109.585 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 432' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' C' ' 428' ' ' ASP . 44.6 mttp -65.05 -43.21 93.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.026 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 433' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.47 -52.45 63.48 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.458 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 434' ' ' THR . . . . . . . . . . . . . 9.1 p -60.22 -52.64 64.42 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.263 -0.175 . . . . 10.0 111.086 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 435' ' ' GLU . . . . . 0.43 ' HA ' ' HD2' ' C' ' 438' ' ' ARG . 6.2 mm-40 -59.41 -42.0 90.78 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.715 0.293 . . . . 10.0 110.858 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 436' ' ' GLY . . . . . . . . . . . . . . . -64.47 -49.12 66.92 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.7 -0.56 . . . . 10.0 111.7 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 437' ' ' LEU . . . . . . . . . . . . . 86.2 mt -64.08 -29.36 70.5 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.822 0.344 . . . . 10.0 110.541 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 438' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' C' ' 435' ' ' GLU . 83.0 mtt180 -65.91 -36.25 82.87 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.109 -0.496 . . . . 10.0 109.853 178.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 439' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' C' ' 435' ' ' GLU . 45.9 mt-30 -66.0 -35.25 80.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.242 0.544 . . . . 10.0 109.786 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 440' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' C' ' 444' ' ' ASP . 37.8 mt-10 -75.09 -51.1 14.32 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.589 -0.732 . . . . 10.0 109.202 178.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 441' ' ' MET . . . . . . . . . . . . . 80.2 mmm -60.22 -35.84 76.36 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 113.034 0.754 . . . . 10.0 113.034 -178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 442' ' ' SER . . . . . . . . . . . . . 38.7 p -59.73 -60.5 3.73 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.777 -0.453 . . . . 10.0 109.777 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 443' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' C' ' 447' ' ' GLU . 28.4 mtpp -64.81 -33.43 75.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.71 -0.677 . . . . 10.0 110.616 179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 444' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' C' ' 440' ' ' GLU . 5.3 t0 -63.24 -60.83 2.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 10.0 111.035 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 445' ' ' LEU . . . . . . . . . . . . . 20.7 mt -61.6 -37.31 83.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.294 -0.412 . . . . 10.0 111.817 -179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 446' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -67.33 -39.19 85.8 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.852 -0.425 . . . . 10.0 109.852 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 447' ' ' GLU . . . . . 0.632 ' HB2' ' O ' ' C' ' 443' ' ' LYS . 2.0 tt0 -69.43 -36.53 76.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.278 -0.638 . . . . 10.0 109.278 178.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 448' ' ' VAL . . . . . 0.451 HG23 ' O ' ' C' ' 444' ' ' ASP . 14.1 t -54.63 -36.75 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.285 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 449' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -61.26 -36.27 79.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.266 0.555 . . . . 10.0 110.485 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 450' ' ' ALA . . . . . . . . . . . . . . . -96.95 11.32 36.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.666 -0.697 . . . . 10.0 111.093 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 451' ' ' LYS . . . . . 0.615 ' O ' ' HB2' ' C' ' 455' ' ' TYR . 33.9 mmtm -117.82 -50.25 2.51 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.776 -0.647 . . . . 10.0 110.488 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 452' ' ' VAL . . . . . 0.422 HG23 HG13 ' C' ' 448' ' ' VAL . 50.3 t -67.61 -39.79 82.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 10.0 111.381 -179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 453' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.05 -59.89 10.44 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 120.96 -0.296 . . . . 10.0 111.169 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 454' ' ' PRO . . . . . 0.445 ' HA ' ' HB3' ' C' ' 457' ' ' ASP . 28.5 Cg_endo -66.26 -26.34 49.11 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.592 1.528 . . . . 10.0 111.492 178.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 455' ' ' TYR . . . . . 0.615 ' HB2' ' O ' ' C' ' 451' ' ' LYS . 8.5 t80 -65.83 -48.49 71.49 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 456' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 -31.82 70.43 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.525 -0.762 . . . . 10.0 110.168 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 457' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' C' ' 454' ' ' PRO . 4.5 t70 -62.8 -52.43 63.2 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.68 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 458' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -63.81 -39.56 94.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.078 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 459' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -65.36 -42.34 92.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.945 -0.571 . . . . 10.0 110.677 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 460' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -63.59 -39.35 94.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.834 -0.432 . . . . 10.0 109.834 178.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 461' ' ' LYS . . . . . 0.652 ' O ' ' HG3' ' C' ' 465' ' ' GLU . 72.2 mttt -60.49 -45.26 94.43 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 462' ' ' LYS . . . . . 0.808 ' HD2' H281 ' C' ' 602' ' ' PCW . 0.7 OUTLIER -66.41 -41.83 88.69 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.324 -0.853 . . . . 10.0 110.624 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 463' ' ' TRP . . . . . . . . . . . . . 20.9 m0 -62.19 -40.51 96.29 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.249 -0.432 . . . . 10.0 109.945 178.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 464' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -62.4 -46.63 87.72 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 465' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' C' ' 461' ' ' LYS . 32.8 mt-10 -59.02 -52.74 64.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.756 -0.657 . . . . 10.0 110.161 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 466' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.35 -47.26 76.01 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.689 0.618 . . . . 10.0 110.222 179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 467' ' ' MET . . . . . . . . . . . . . 41.5 ttm -59.48 -44.29 93.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.039 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.52 -39.21 81.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.179 0.514 . . . . 10.0 110.221 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 469' ' ' LEU . . . . . 0.621 HD22 ' HZ3' ' C' ' 473' ' ' LYS . 83.9 mt -62.96 -30.37 71.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.588 -0.733 . . . . 10.0 110.059 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 470' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -68.72 -27.74 66.2 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 121.14 0.495 . . . . 10.0 109.765 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 471' ' ' ARG . . . . . 0.763 ' HA ' ' HG3' ' C' ' 475' ' ' GLU . 95.7 mtt180 -74.44 -29.76 61.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.548 -0.538 . . . . 10.0 109.548 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 472' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -95.9 -1.77 48.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.747 -0.661 . . . . 10.0 111.043 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 473' ' ' LYS . . . . . 0.621 ' HZ3' HD22 ' C' ' 469' ' ' LEU . 47.5 mttp -129.48 -71.35 0.62 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.318 -0.401 . . . . 10.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 474' ' ' VAL . . . . . . . . . . . . . 91.3 t -52.69 -45.56 48.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 112.516 0.562 . . . . 10.0 112.516 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 475' ' ' GLU . . . . . 0.763 ' HG3' ' HA ' ' C' ' 471' ' ' ARG . 15.6 mt-10 -60.42 -61.13 8.56 Favored Pre-proline 0 CA--C 1.54 0.581 0 N-CA-C 112.276 0.473 . . . . 10.0 112.276 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 476' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -62.46 -33.27 79.65 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.737 1.624 . . . . 10.0 111.485 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 477' ' ' LEU . . . . . . . . . . . . . 36.2 mt -67.27 -32.52 73.58 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.623 -0.51 . . . . 10.0 109.623 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 478' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' C' ' 478' ' ' ARG . 1.9 mtt180 -69.87 -35.14 74.43 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.434 -0.95 . . . . 10.0 108.434 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 479' ' ' ALA . . . . . . . . . . . . . . . -70.15 -42.1 72.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.75 -0.834 . . . . 10.0 108.75 178.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 480' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.13 -43.43 98.41 Favored 'General case' 0 N--CA 1.457 -0.092 0 N-CA-C 108.643 -0.873 . . . . 10.0 108.643 178.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 12.1 mt -66.91 -33.64 76.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.401 -0.818 . . . . 10.0 110.05 178.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 482' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -62.58 -52.37 63.65 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 109.218 -0.66 . . . . 10.0 109.218 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 483' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.22 -45.01 96.32 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 484' ' ' GLY . . . . . . . . . . . . . . . -61.63 -39.79 97.86 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.267 -0.878 . . . . 10.0 111.749 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.12 68.35 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 110.197 -0.297 . . . . 10.0 110.197 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 486' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -60.73 -43.86 97.37 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.2 -0.667 . . . . 10.0 109.2 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 487' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -70.03 -39.87 75.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.8 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 488' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -58.04 -47.95 81.57 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 10.0 109.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 489' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.96 -33.52 76.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.542 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 490' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -66.99 -46.62 74.03 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.91 -0.774 . . . . 10.0 108.91 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 491' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -59.19 -45.28 91.46 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.848 -0.797 . . . . 10.0 108.848 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 492' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.25 -45.92 82.63 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 115.502 -0.772 . . . . 10.0 111.656 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 493' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -59.29 -40.8 87.28 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.751 0.31 . . . . 10.0 111.455 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 494' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -73.17 -0.83 15.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.131 0.491 . . . . 10.0 111.462 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 495' ' ' LYS . . . . . 0.842 ' HE3' HD22 ' A' ' 279' ' ' LEU . 14.7 mttp -116.54 -36.25 4.01 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.114 178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 496' ' ' LEU . . . . . 0.44 ' O ' ' HA3' ' C' ' 500' ' ' GLY . 68.5 mt -67.18 -24.58 65.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.299 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 497' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' C' ' 498' ' ' PRO . 2.1 m -78.63 -64.42 0.37 Allowed Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 112.049 0.389 . . . . 10.0 112.049 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 498' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' C' ' 497' ' ' SER . 32.1 Cg_endo -64.89 -48.91 3.33 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 121.781 1.654 . . . . 10.0 112.048 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 499' ' ' LEU . . . . . 0.601 HD21 ' HG2' ' A' ' 275' ' ' LYS . 76.8 mt -70.67 -27.43 64.02 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.963 0.411 . . . . 10.0 110.238 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 500' ' ' GLY . . . . . 0.44 ' HA3' ' O ' ' C' ' 496' ' ' LEU . . . -66.34 -46.42 78.6 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 109.826 -1.309 . . . . 10.0 109.826 177.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 501' ' ' GLU . . . . . 0.523 ' HA ' ' HD2' ' C' ' 504' ' ' ARG . 31.5 mt-10 -68.04 -35.55 78.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.998 -0.741 . . . . 10.0 108.998 178.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 502' ' ' GLU . . . . . 0.519 ' O ' ' HG3' ' C' ' 506' ' ' ARG . 35.3 tt0 -61.36 -45.37 94.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.429 -0.805 . . . . 10.0 108.893 178.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 503' ' ' MET . . . . . 0.475 ' SD ' ' HD2' ' C' ' 506' ' ' ARG . 59.0 mmm -63.96 -37.22 86.63 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.081 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 504' ' ' ARG . . . . . 0.523 ' HD2' ' HA ' ' C' ' 501' ' ' GLU . 74.5 mtt180 -64.78 -40.61 95.53 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.987 -0.551 . . . . 10.0 109.727 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 505' ' ' ASP . . . . . 0.422 ' OD1' ' HD2' ' C' ' 508' ' ' ARG . 1.1 m-20 -68.62 -39.68 80.7 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.912 -0.586 . . . . 10.0 109.993 178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 506' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' C' ' 502' ' ' GLU . 62.3 mtt180 -59.59 -45.53 91.62 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 107.917 -1.142 . . . . 10.0 107.917 177.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 507' ' ' ALA . . . . . . . . . . . . . . . -63.24 -38.95 93.16 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.927 178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 508' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' C' ' 504' ' ' ARG . 82.8 mtt180 -59.68 -51.24 70.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 178.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 509' ' ' ALA . . . . . 0.659 ' HB1' ' HE2' ' A' ' 264' ' ' LYS . . . -64.93 -33.84 76.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.506 -0.77 . . . . 10.0 111.672 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 510' ' ' HIS . . . . . . . . . . . . . 28.1 m-70 -75.26 -47.94 25.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.558 -0.292 . . . . 10.0 111.036 179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 511' ' ' VAL . . . . . 0.617 ' HA ' HD12 ' C' ' 514' ' ' LEU . 71.0 t -65.44 -41.32 90.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 10.0 110.105 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 512' ' ' ASP . . . . . 0.738 ' HA ' ' HD2' ' C' ' 515' ' ' ARG . 4.9 t70 -64.51 -30.36 71.39 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.285 -0.635 . . . . 10.0 109.285 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 513' ' ' ALA . . . . . . . . . . . . . . . -66.01 -44.71 83.97 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 108.286 -1.005 . . . . 10.0 108.286 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 514' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' C' ' 511' ' ' VAL . 25.8 mt -60.95 -34.4 74.67 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-N 115.809 -0.632 . . . . 10.0 109.486 178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 515' ' ' ARG . . . . . 0.738 ' HD2' ' HA ' ' C' ' 512' ' ' ASP . 90.5 mtt180 -67.19 -25.95 66.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.668 179.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 516' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -104.86 -3.82 22.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.9 0.381 . . . . 10.0 111.072 -179.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 517' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -115.42 -65.56 1.18 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 111.913 0.338 . . . . 10.0 111.913 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 518' ' ' LEU . . . . . . . . . . . . . 35.0 mt -66.61 -44.68 81.46 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.588 0.588 . . . . 10.0 112.588 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 519' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' C' ' 520' ' ' PRO . . . -55.24 -59.18 11.71 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 112.314 0.487 . . . . 10.0 112.314 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 520' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' C' ' 519' ' ' ALA . 31.3 Cg_exo -62.74 -36.41 62.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.096 1.864 . . . . 10.0 111.886 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 521' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -68.45 -32.96 73.36 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 116.415 -0.357 . . . . 10.0 110.987 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 522' ' ' SER . . . . . . . . . . . . . 27.6 p -66.43 -29.17 69.26 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.901 0.382 . . . . 10.0 110.149 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 523' ' ' ASP . . . . . . . . . . . . . 40.3 t0 -71.98 -42.87 65.98 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.4 -0.963 . . . . 10.0 108.4 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 524' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.83 -40.28 96.22 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.37 -0.832 . . . . 10.0 109.098 178.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 525' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' C' ' 529' ' ' LEU . 45.7 mt -62.1 -42.28 99.06 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.44 -0.8 . . . . 10.0 109.721 178.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 526' ' ' ARG . . . . . . . . . . . . . 35.7 mtm180 -60.88 -33.69 73.48 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 527' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -70.09 -35.79 74.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 10.0 109.725 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 528' ' ' ARG . . . . . 0.708 ' NH1' ' HA ' ' A' ' 246' ' ' ASP . 86.5 mtt180 -74.35 -41.8 60.45 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.157 -0.682 . . . . 10.0 109.157 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 529' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' C' ' 525' ' ' LEU . 97.0 mt -62.59 -27.95 69.54 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.185 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 530' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' C' ' 534' ' ' GLU . . . -64.91 -36.5 84.58 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 531' ' ' ALA . . . . . . . . . . . . . . . -77.96 -38.89 44.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.671 -0.695 . . . . 10.0 109.2 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 532' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -61.59 -46.91 87.85 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.597 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 533' ' ' LEU . . . . . . . . . . . . . 78.3 mt -68.02 -33.36 74.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.638 -0.71 . . . . 10.0 109.948 178.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 534' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' C' ' 530' ' ' ALA . 12.2 tt0 -66.44 -37.86 86.09 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.103 -0.703 . . . . 10.0 109.103 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.94 79.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.958 -0.756 . . . . 10.0 108.958 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 536' ' ' LEU . . . . . 0.435 ' O ' ' HA3' ' C' ' 540' ' ' GLY . 37.3 mt -72.59 -30.95 64.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.566 -0.743 . . . . 10.0 110.277 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 537' ' ' LYS . . . . . . . . . . . . . 86.6 mttt -75.89 -45.03 37.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.186 -0.461 . . . . 10.0 109.994 178.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 538' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.79 -65.7 0.64 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.468 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 539' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -63.01 -30.37 71.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.141 -0.481 . . . . 10.0 110.276 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 540' ' ' GLY . . . . . 0.499 ' O ' ' HG ' ' C' ' 544' ' ' LEU . . . -65.66 -46.84 81.81 Favored Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 111.352 -0.699 . . . . 10.0 111.352 179.241 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 541' ' ' GLY . . . . . . . . . . . . . . . -61.76 -41.18 99.58 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.69 -0.964 . . . . 10.0 110.69 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 542' ' ' ALA . . . . . . . . . . . . . . . -63.4 -48.66 76.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.614 -0.513 . . . . 10.0 109.614 178.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 543' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.11 -32.13 73.43 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 115.866 -0.606 . . . . 10.0 111.265 179.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 544' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' C' ' 540' ' ' GLY . 53.5 mt -63.54 -40.22 96.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 109.263 -0.643 . . . . 10.0 109.263 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 545' ' ' ALA . . . . . . . . . . . . . . . -71.3 -40.65 70.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.486 -0.779 . . . . 10.0 108.955 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 546' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.86 -45.33 89.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.363 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 547' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -59.77 -39.82 86.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.896 -0.409 . . . . 10.0 109.896 178.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 548' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -71.48 -44.42 64.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.939 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 549' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.63 93.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.179 0.514 . . . . 10.0 110.429 179.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 550' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' C' ' 554' ' ' HIS . 0.0 OUTLIER -73.05 -19.42 61.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.874 -0.603 . . . . 10.0 110.058 179.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 551' ' ' ALA . . . . . . . . . . . . . . . -71.47 -44.25 65.11 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 552' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -41.16 91.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 123.419 0.45 . . . . 10.0 109.858 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 553' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -63.4 -41.66 98.76 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.131 -0.486 . . . . 10.0 109.69 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 554' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' C' ' 550' ' ' LYS . 0.3 OUTLIER -70.12 -36.11 74.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.156 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 555' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.88 -43.3 79.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.893 -0.594 . . . . 10.0 111.446 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 556' ' ' SER . . . . . . . . . . . . . 5.0 p -65.3 -42.85 92.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 10.0 110.57 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 557' ' ' THR . . . . . . . . . . . . . 3.8 p -70.85 -30.5 66.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.063 0.458 . . . . 10.0 110.003 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 558' ' ' LEU . . . . . . . . . . . . . 4.7 mt -65.65 -47.21 76.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.868 -0.605 . . . . 10.0 109.551 178.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 559' ' ' SER . . . . . . . . . . . . . 1.6 p -70.24 -26.79 64.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.194 0.521 . . . . 10.0 109.603 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 560' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -68.72 -25.71 64.9 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.433 -0.803 . . . . 10.0 109.519 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 561' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 -42.66 7.42 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.04 -0.527 . . . . 10.0 110.909 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 562' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.9 72.9 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.653 0.612 . . . . 10.0 112.653 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 563' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -55.01 -62.32 4.44 Favored Pre-proline 0 CA--C 1.536 0.41 0 N-CA-C 113.04 0.755 . . . . 10.0 113.04 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 564' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' C' ' 568' ' ' ASP . 31.5 Cg_endo -65.19 -36.99 33.98 Favored 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.057 1.838 . . . . 10.0 112.633 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 565' ' ' ALA . . . . . . . . . . . . . . . -64.61 -47.2 79.48 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 121.329 -0.149 . . . . 10.0 111.175 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 566' ' ' LEU . . . . . . . . . . . . . 68.6 mt -67.56 -41.46 84.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.642 0.258 . . . . 10.0 110.369 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 567' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.49 -45.72 82.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.899 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 568' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' C' ' 564' ' ' PRO . 0.4 OUTLIER -63.82 -35.96 82.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.622 -0.51 . . . . 10.0 109.622 178.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 569' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.31 -48.96 78.94 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 108.812 -0.81 . . . . 10.0 108.812 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 570' ' ' ARG . . . . . . . . . . . . . 75.3 mtt180 -65.05 -40.75 95.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.691 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 571' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -60.42 -30.64 69.75 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.227 -0.442 . . . . 10.0 111.538 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 572' ' ' GLY . . . . . 0.509 ' O ' ' HB ' ' C' ' 576' ' ' VAL . . . -96.6 -29.83 8.01 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.106 -0.569 . . . . 10.0 112.033 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 573' ' ' LEU . . . . . . . . . . . . . 22.6 mt -64.74 -41.04 96.23 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 111.815 0.302 . . . . 10.0 111.815 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 574' ' ' LEU . . . . . . . . . . . . . 71.0 mt -56.5 -60.0 10.5 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.138 0.421 . . . . 10.0 112.138 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 575' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -63.56 -33.88 66.19 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 121.933 1.756 . . . . 10.0 111.31 178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 576' ' ' VAL . . . . . 0.509 ' HB ' ' O ' ' C' ' 572' ' ' GLY . 0.4 OUTLIER -68.1 -36.01 73.73 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.181 0 C-N-CA 121.201 -0.2 . . . . 10.0 110.892 179.432 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 577' ' ' LEU . . . . . . . . . . . . . 37.3 mt -66.63 -42.12 87.25 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.147 -0.686 . . . . 10.0 109.147 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 578' ' ' GLU . . . . . 0.497 ' O ' HG23 ' C' ' 582' ' ' VAL . 55.3 mm-40 -63.21 -38.27 90.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.464 178.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 579' ' ' SER . . . . . . . . . . . . . 23.1 m -66.97 -43.11 83.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.753 -0.658 . . . . 10.0 109.405 178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 580' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -60.1 -43.73 95.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.903 -0.59 . . . . 10.0 110.401 178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 581' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.55 -36.83 76.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.0 -0.545 . . . . 10.0 110.419 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 582' ' ' VAL . . . . . 0.497 HG23 ' O ' ' C' ' 578' ' ' GLU . 76.2 t -62.12 -48.33 88.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.183 -0.462 . . . . 10.0 110.474 179.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 583' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -40.5 83.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.055 -0.521 . . . . 10.0 111.487 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 584' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -68.34 -43.72 76.88 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.591 0.234 . . . . 10.0 111.517 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 585' ' ' LEU . . . . . 0.45 ' HA ' HD23 ' C' ' 585' ' ' LEU . 10.6 mt -62.11 -50.69 70.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.461 -0.336 . . . . 10.0 110.896 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 586' ' ' SER . . . . . . . . . . . . . 28.0 p -62.05 -32.0 72.46 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.281 0.563 . . . . 10.0 110.457 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 587' ' ' ALA . . . . . . . . . . . . . . . -68.12 -53.88 22.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.676 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 588' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.79 -43.71 94.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.873 0.368 . . . . 10.0 111.193 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 589' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -56.58 -47.66 79.06 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.064 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 590' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -76.83 -34.67 57.88 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 591' ' ' TYR . . . . . 0.605 ' HB3' ' H48' ' C' ' 630' ' ' 17F . 2.6 m-30 -61.67 -41.15 97.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.748 0.309 . . . . 10.0 110.944 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 592' ' ' THR . . . . . . . . . . . . . 18.5 m -65.53 -22.95 66.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.255 -0.43 . . . . 10.0 110.95 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 593' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -85.16 -40.89 16.2 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.136 0.493 . . . . 10.0 110.437 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 594' ' ' LYS . . . . . 0.625 ' HE2' ' HB2' ' A' ' 388' ' ' SER . 11.0 mptt -70.4 -33.58 71.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.54 . . . . 10.0 111.018 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 595' ' ' LEU . . . . . . . . . . . . . 82.5 mt -101.82 30.9 4.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 10.0 110.455 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 596' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.887 -179.435 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.603 ' HA ' ' HB ' ' B' ' 50' ' ' THR . 54.5 mtm . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.078 0.466 . . . . 10.0 111.016 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.44 139.15 31.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.166 -0.47 . . . . 10.0 111.192 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.638 ' HA ' ' HB3' ' B' ' 52' ' ' LEU . 20.7 tt0 -94.55 146.2 24.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.855 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -135.9 135.03 39.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.441 -0.345 . . . . 10.0 110.173 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -95.98 116.39 28.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.54 -0.3 . . . . 10.0 111.261 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.472 HD11 HD22 ' B' ' 53' ' ' LEU . 39.3 mt -118.02 124.04 47.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.433 -0.349 . . . . 10.0 110.537 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.01 127.42 68.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 120.916 0.388 . . . . 10.0 110.625 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' VAL . . . . . 0.672 HG12 ' HB2' ' B' ' 79' ' ' LEU . 3.8 m -102.69 134.4 43.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.465 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.42 HG21 HD11 ' B' ' 100' ' ' ILE . 18.1 m -128.32 159.39 39.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.924 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 160.08 172.07 26.82 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 121.038 -0.601 . . . . 10.0 111.613 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.07 168.9 16.47 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.901 0.382 . . . . 10.0 110.951 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.77 123.05 6.88 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.479 -0.867 . . . . 10.0 111.982 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 111.48 0.62 27.82 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.748 -0.739 . . . . 10.0 113.048 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 34.1 m -79.97 -25.1 11.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.288 0.477 . . . . 10.0 112.288 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . 0.531 ' CA ' ' H8 ' ' B' ' 216' ' ' GNP . . . 98.27 35.75 4.89 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.564 -0.827 . . . . 10.0 111.42 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.613 ' HB3' ' O1G' ' B' ' 216' ' ' GNP . 17.2 ttpp -68.64 -49.96 55.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.29 . . . . 10.0 111.091 -179.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 60.5 m -69.47 -32.5 71.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.793 0.33 . . . . 10.0 110.662 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.71 72.38 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.039 -0.528 . . . . 10.0 109.939 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 26.4 mt -61.3 -29.68 70.02 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.807 -0.633 . . . . 10.0 110.71 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -71.65 -58.17 3.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.884 -0.598 . . . . 10.0 112.031 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.656 HG21 ' HB ' ' D' ' 388' ' ' VAL . 26.4 mt -59.6 -37.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 120.758 0.313 . . . . 10.0 110.574 -179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.767 ' HG3' ' HG3' ' B' ' 149' ' ' ARG . 18.2 tp60 -65.0 -19.34 65.95 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' B' ' 153' ' ' ASP . 18.8 tp -105.17 -41.29 5.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.741 0.305 . . . . 10.0 111.594 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ILE . . . . . . . . . . . . . 48.2 mm -72.58 -52.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.069 0.396 . . . . 10.0 112.069 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -109.59 -2.56 17.46 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.985 0.365 . . . . 10.0 111.985 -179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' B' ' 22' ' ' GLN . 94.6 m-20 63.69 32.35 13.83 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.025 -0.534 . . . . 10.0 112.3 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -120.97 148.08 44.58 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.117 -0.492 . . . . 10.0 109.791 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -105.36 154.87 19.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 10.0 111.38 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' VAL . . . . . 0.508 HG12 HG11 ' D' ' 388' ' ' VAL . 26.9 m -93.0 171.11 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.383 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -130.8 -57.2 1.05 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.689 -0.485 . . . . 10.0 109.689 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -93.33 156.11 16.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.847 -0.615 . . . . 10.0 109.822 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -94.23 124.03 38.0 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.12 0.486 . . . . 10.0 111.86 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -133.34 110.74 12.69 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.851 -0.796 . . . . 10.0 108.851 178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -51.23 129.8 30.02 Favored 'Trans proline' 0 N--CA 1.474 0.339 0 C-N-CA 123.342 2.695 . . . . 10.0 113.697 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' THR . . . . . 0.56 ' O ' ' HA ' ' B' ' 59' ' ' ALA . 0.0 OUTLIER -99.5 142.7 30.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.974 179.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 4.2 mp -114.83 -51.78 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 121.091 -0.244 . . . . 10.0 111.548 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.802 ' HB3' ' CG2' ' D' ' 369' ' ' VAL . 28.2 tt0 -138.39 93.0 2.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.992 0.425 . . . . 10.0 110.225 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 57' ' ' ASP . 27.8 t70 -117.28 142.34 47.19 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.671 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 15.6 m -148.0 106.87 3.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.715 0.293 . . . . 10.0 110.986 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -117.04 122.76 45.1 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 112.592 0.59 . . . . 10.0 112.592 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ARG . . . . . 0.527 HH11 HD11 ' B' ' 52' ' ' LEU . 0.0 OUTLIER -113.62 144.85 42.21 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.438 -0.578 . . . . 10.0 109.438 178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -135.65 141.41 45.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.706 0.288 . . . . 10.0 111.647 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -87.66 96.12 10.31 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.0 -0.546 . . . . 10.0 109.858 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 10.7 m -131.49 149.4 33.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.21 0.528 . . . . 10.0 111.817 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 57.3 t -95.26 122.75 47.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.852 178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.715 ' HB ' ' SG ' ' B' ' 51' ' ' CYS . 82.9 mt -125.17 109.11 21.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.318 0.58 . . . . 10.0 111.37 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 69.22 38.97 1.78 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 114.352 1.242 . . . . 10.0 114.352 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.61 7.92 77.94 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.621 -0.799 . . . . 10.0 114.834 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -140.07 148.91 42.45 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 117.286 0.543 . . . . 10.0 110.18 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.603 ' HB ' ' HA ' ' B' ' 1' ' ' MET . 1.5 m -76.11 106.12 7.54 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.722 -0.473 . . . . 10.0 109.722 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' CYS . . . . . 0.715 ' SG ' ' HB ' ' B' ' 46' ' ' ILE . 75.4 m -97.49 107.34 19.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.282 0.563 . . . . 10.0 110.466 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.638 ' HB3' ' HA ' ' B' ' 3' ' ' GLU . 11.4 tp -85.23 86.34 7.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.892 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.472 HD22 HD11 ' B' ' 6' ' ' LEU . 74.1 mt -80.14 116.91 20.51 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.756 -0.656 . . . . 10.0 111.688 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -108.88 109.3 20.36 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.82 -1.178 . . . . 10.0 107.82 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 5.7 mt -94.64 153.94 3.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.22 -0.446 . . . . 10.0 111.574 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.64 111.61 11.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.315 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 1.05 ' HB3' ' HB3' ' B' ' 38' ' ' ASP . 11.6 t0 -87.82 113.94 23.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.331 -0.618 . . . . 10.0 109.331 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' THR . . . . . . . . . . . . . 23.1 p -92.67 155.04 17.99 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.327 -0.397 . . . . 10.0 110.281 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.63 ' HB2' ' HA ' ' B' ' 36' ' ' ILE . . . -63.8 121.83 14.97 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.533 -0.303 . . . . 10.0 111.009 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.72 -37.15 35.21 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 111.086 -0.805 . . . . 10.0 111.086 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -97.12 58.87 1.59 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.112 0.482 . . . . 10.0 110.666 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -142.23 144.81 33.52 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.933 -0.766 . . . . 10.0 108.933 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' H ' ' B' ' 64' ' ' TYR . 25.6 mt-10 -94.05 -157.67 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 10.0 111.883 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' TYR . . . . . 0.451 ' H ' ' HB3' ' B' ' 63' ' ' GLU . 11.0 t80 -63.93 113.45 3.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 10.0 111.488 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 15.3 m -123.35 145.23 48.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 10.0 110.051 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.28 -40.58 74.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.333 -0.394 . . . . 10.0 110.85 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' MET . . . . . . . . . . . . . 94.6 mmm -67.96 -20.75 65.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.476 -0.329 . . . . 10.0 111.298 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.626 ' HA ' ' CZ ' ' B' ' 71' ' ' TYR . 20.5 ttm-85 -64.59 -38.74 92.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.442 . . . . 10.0 109.985 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.7 -30.13 71.13 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 116.003 -0.544 . . . . 10.0 110.111 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -66.91 -64.22 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.589 -0.732 . . . . 10.0 112.626 -178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' TYR . . . . . 0.626 ' CZ ' ' HA ' ' B' ' 68' ' ' ARG . 5.4 p90 -71.15 -21.41 62.19 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 114.304 1.224 . . . . 10.0 114.304 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' MET . . . . . 0.448 ' CE ' HG21 ' B' ' 103' ' ' VAL . 17.1 ttp -78.64 -28.13 45.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.912 0.387 . . . . 10.0 110.295 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' B' ' 73' ' ' ARG . 42.7 ttm105 -74.1 -26.34 60.3 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.306 -0.406 . . . . 10.0 110.921 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.23 -13.69 60.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.089 -0.505 . . . . 10.0 111.444 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.79 145.68 30.28 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.716 -0.754 . . . . 10.0 112.346 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -101.17 -42.93 6.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.745 -0.465 . . . . 10.0 109.745 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.36 140.91 16.65 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.824 -0.91 . . . . 10.0 110.824 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.417 ' O ' ' HA ' ' B' ' 111' ' ' MET . 90.5 m-85 -122.76 129.14 51.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.485 0.66 . . . . 10.0 112.075 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.672 ' HB2' HG12 ' B' ' 8' ' ' VAL . 4.8 mp -112.76 117.63 32.72 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.592 -0.731 . . . . 10.0 110.204 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' CYS . . . . . 0.408 ' HB3' HD12 ' B' ' 93' ' ' ILE . 12.5 m -96.36 99.22 10.92 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.633 HG12 ' HB ' ' B' ' 114' ' ' VAL . 26.4 m -98.22 141.13 16.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.16 0.505 . . . . 10.0 111.579 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' PHE . . . . . 0.71 ' HB2' ' HB2' ' B' ' 89' ' ' SER . 33.0 p90 -150.9 161.43 42.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.408 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ALA . . . . . 0.475 ' HB1' ' OD1' ' B' ' 85' ' ' ASN . . . -97.28 124.3 41.35 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.412 -0.588 . . . . 10.0 109.412 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' B' ' 118' ' ' CYS . 30.7 pt -74.09 -5.44 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 113.008 0.744 . . . . 10.0 113.008 -178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . 0.475 ' OD1' ' HB1' ' B' ' 83' ' ' ALA . 26.4 p-10 -90.79 5.97 46.16 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.196 0.522 . . . . 10.0 110.484 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -143.31 119.55 10.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.854 -0.612 . . . . 10.0 109.491 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -27.12 67.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.229 -0.441 . . . . 10.0 112.147 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LYS . . . . . . . . . . . . . 21.6 tptp -58.22 -47.7 82.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.419 -0.355 . . . . 10.0 110.849 -179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' SER . . . . . 0.71 ' HB2' ' HB2' ' B' ' 82' ' ' PHE . 0.0 OUTLIER -61.28 -31.71 71.53 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -68.1 -46.87 69.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.323 0.583 . . . . 10.0 111.139 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -79.33 -19.52 50.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.282 -0.417 . . . . 10.0 111.335 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.86 -25.36 62.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 10.0 110.559 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . 0.512 HD11 ' HB3' ' B' ' 82' ' ' PHE . 39.0 mm -56.17 -39.81 61.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.976 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -57.38 -39.64 76.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.963 0.411 . . . . 10.0 110.88 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -62.73 -46.7 86.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.965 -0.562 . . . . 10.0 110.84 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -70.92 -36.48 72.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.332 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -59.34 -55.93 28.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.296 -0.411 . . . . 10.0 111.516 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' B' ' 101' ' ' LYS . 66.2 mm-40 -63.69 -25.7 68.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.921 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' GLN . . . . . 0.466 ' O ' HG23 ' B' ' 103' ' ' VAL . 32.4 tt0 -71.36 -51.08 26.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.962 -0.563 . . . . 10.0 110.01 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ILE . . . . . 0.42 HD11 HG21 ' B' ' 9' ' ' VAL . 97.1 mt -59.05 -40.7 81.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-N 115.849 -0.614 . . . . 10.0 110.71 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' LYS . . . . . 0.434 ' HD3' ' HA ' ' B' ' 98' ' ' GLU . 55.2 mtpt -55.35 -42.78 74.31 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.161 -0.472 . . . . 10.0 111.337 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 39.5 ttp85 -72.0 -42.06 66.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.441 . . . . 10.0 111.056 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 99' ' ' GLN . 97.5 t -61.19 -43.33 96.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.991 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -82.12 -10.59 59.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.24 -0.436 . . . . 10.0 111.183 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' ASP . . . . . . . . . . . . . 29.3 t0 61.42 37.12 16.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.628 -0.715 . . . . 10.0 110.813 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 73.8 m -155.9 139.93 16.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.233 -179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -80.72 -41.3 23.82 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.112 0.482 . . . . 10.0 110.577 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -92.64 87.5 5.93 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.054 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 m -120.47 148.89 48.77 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.775 -0.648 . . . . 10.0 109.85 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.33 107.65 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.742 2.295 . . . . 10.0 112.066 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' MET . . . . . 0.417 ' HA ' ' O ' ' B' ' 78' ' ' PHE . 28.9 mtm -139.87 137.89 35.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.167 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 95.4 t -127.7 135.52 62.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 110.057 -0.349 . . . . 10.0 110.057 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' B' ' 82' ' ' PHE . 15.7 tp -88.5 119.34 28.86 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.909 -0.404 . . . . 10.0 109.909 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' VAL . . . . . 0.633 ' HB ' HG12 ' B' ' 81' ' ' VAL . 41.3 t -117.73 121.21 66.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.019 0.438 . . . . 10.0 111.352 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -100.11 115.94 5.44 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.833 -0.907 . . . . 10.0 110.833 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' ASN . . . . . 0.59 ' OD1' ' HA ' ' B' ' 145' ' ' SER . 66.4 t30 -98.29 162.24 13.28 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 123.611 0.242 . . . . 10.0 110.681 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' B' ' 120' ' ' LEU . 84.8 mttt 65.18 44.27 3.36 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.405 0.622 . . . . 10.0 111.145 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' CYS . . . . . 0.779 ' HA ' HD11 ' B' ' 84' ' ' ILE . 26.9 p -84.76 -20.43 31.08 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.96 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 15.1 p-10 -87.29 -6.71 58.43 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.081 0.401 . . . . 10.0 112.081 -178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' B' ' 117' ' ' LYS . 59.3 mt -80.64 142.69 53.58 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.33 35.93 0.56 Allowed 'Trans proline' 0 CA--C 1.533 0.447 0 C-N-CA 123.005 2.47 . . . . 10.0 112.91 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.2 26.47 5.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.581 0.705 . . . . 10.0 109.907 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.625 ' HG3' HD12 ' B' ' 84' ' ' ILE . 32.5 ttm-85 -57.63 116.24 3.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.021 -0.99 . . . . 10.0 110.966 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' THR . . . . . . . . . . . . . 28.9 m -102.04 -59.02 1.77 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.64 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 6.2 t -79.32 126.46 39.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.031 -0.532 . . . . 10.0 110.363 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . 0.538 ' HB3' ' HG3' ' B' ' 129' ' ' GLN . 20.1 t70 -75.27 147.07 40.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.023 -0.535 . . . . 10.0 111.297 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 7.0 m -53.76 -36.38 62.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.879 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -66.74 -38.56 86.9 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.77 -0.372 . . . . 10.0 111.224 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . 0.538 ' HG3' ' HB3' ' B' ' 126' ' ' ASP . 42.6 mt-30 -60.08 -39.69 86.96 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.927 0.394 . . . . 10.0 110.921 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -78.39 -43.71 26.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.868 -0.605 . . . . 10.0 111.151 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -66.07 -41.58 90.58 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.94 -45.85 87.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.045 0.45 . . . . 10.0 110.617 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.81 -44.71 89.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.526 . . . . 10.0 110.226 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.04 -46.43 88.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 10.0 111.179 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -65.96 -30.54 71.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.232 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 50.2 m -66.11 -28.02 68.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.146 0.498 . . . . 10.0 110.365 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -89.54 -35.06 16.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.936 -0.575 . . . . 10.0 109.47 178.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' GLY . . . . . . . . . . . . . . . 111.68 18.51 7.91 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.4 -0.818 . . . . 10.0 111.651 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 46.2 pt -113.63 157.56 41.21 Favored Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 122.767 -0.255 . . . . 10.0 110.543 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -88.83 166.64 5.92 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.763 2.309 . . . . 10.0 112.2 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -132.49 132.15 42.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.31 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.417 ' CD1' ' H61' ' B' ' 210' ' ' PCW . 43.5 mm -120.94 121.06 64.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.382 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -96.0 116.79 29.48 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.763 -0.829 . . . . 10.0 108.763 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' B' ' 116' ' ' ASN . 0.1 OUTLIER -150.76 178.11 9.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.074 0.398 . . . . 10.0 112.074 -178.341 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' SER . . . . . 0.59 ' HA ' ' OD1' ' B' ' 116' ' ' ASN . 30.5 m -147.81 141.88 26.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.892 -0.594 . . . . 10.0 109.684 179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' ALA . . . . . 0.435 ' N ' ' O6 ' ' B' ' 216' ' ' GNP . . . -78.12 -28.33 48.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.425 -0.954 . . . . 10.0 108.425 178.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -62.87 -38.78 92.22 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.636 -1.165 . . . . 10.0 111.076 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -94.04 -34.4 13.03 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.383 -0.371 . . . . 10.0 111.424 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' ARG . . . . . 0.767 ' HG3' ' HG3' ' B' ' 22' ' ' GLN . 11.6 ttt-85 62.1 32.34 17.51 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.02 0.438 . . . . 10.0 111.981 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -109.95 101.48 10.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.803 0.335 . . . . 10.0 111.034 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 112.07 -16.83 25.0 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.588 -0.733 . . . . 10.0 112.571 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' VAL . . . . . . . . . . . . . 17.7 t -63.84 -37.02 78.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.808 0.337 . . . . 10.0 111.572 -178.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' ASP . . . . . 0.458 ' HA ' HD11 ' B' ' 23' ' ' LEU . 0.5 OUTLIER -60.61 -59.15 5.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.169 -0.468 . . . . 10.0 112.077 -178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.18 -21.1 63.08 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.401 0.519 . . . . 10.0 112.401 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' ALA . . . . . . . . . . . . . . . -60.57 -40.93 93.5 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.016 -0.364 . . . . 10.0 110.016 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -74.08 -30.29 62.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.221 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -67.44 -44.3 79.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.262 0.553 . . . . 10.0 109.563 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' THR . . . . . . . . . . . . . 12.2 m -62.25 -34.03 75.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.646 -0.706 . . . . 10.0 110.276 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' LEU . . . . . . . . . . . . . 18.1 tp -57.24 -41.06 78.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.598 -0.728 . . . . 10.0 109.739 178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.42 -38.19 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.809 -0.632 . . . . 10.0 110.152 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -56.59 -45.76 81.2 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.127 0.489 . . . . 10.0 111.251 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.8 -41.42 97.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.291 -0.413 . . . . 10.0 110.974 179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' ILE . . . . . 0.556 HG22 ' HE2' ' B' ' 167' ' ' LYS . 86.3 mt -65.58 -39.23 84.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.494 -0.321 . . . . 10.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' ARG . . . . . . . . . . . . . 13.6 ttm105 -61.87 -44.67 96.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.352 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' LYS . . . . . . . . . . . . . 46.9 mtmt -68.23 -31.03 70.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.088 0.471 . . . . 10.0 110.597 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -63.78 -41.9 97.87 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.908 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' LYS . . . . . 0.556 ' HE2' HG22 ' B' ' 163' ' ' ILE . 67.9 mttm -62.16 -42.02 98.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.61 -0.723 . . . . 10.0 111.226 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.666 ' HG2' ' HE2' ' B' ' 172' ' ' LYS . 24.0 tt0 -66.8 -40.87 88.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.16 0.505 . . . . 10.0 110.068 178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' LYS . . . . . 0.783 ' HG3' ' H82' ' B' ' 202' ' ' PCW . 34.4 ttpt -59.74 -46.87 87.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.49 -0.777 . . . . 10.0 111.086 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.36 -27.85 69.6 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.014 -0.539 . . . . 10.0 112.223 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' SER . . . . . . . . . . . . . 62.7 m -82.51 -23.48 34.6 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.289 0.477 . . . . 10.0 112.289 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' LYS . . . . . 0.666 ' HE2' ' HG2' ' B' ' 168' ' ' GLU . 55.3 mtmt -99.83 -39.47 8.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.699 0.629 . . . . 10.0 112.699 -178.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -78.15 -54.75 5.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.856 0.36 . . . . 10.0 111.299 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' GLY . . . . . . . . . . . . . . . 127.99 -95.09 0.4 Allowed Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 110.736 -0.945 . . . . 10.0 110.736 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -168.98 48.7 0.04 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.209 0.528 . . . . 10.0 111.118 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' LYS . . . . . 0.42 ' HB3' ' HE2' ' B' ' 176' ' ' LYS . 28.4 mtpt -125.01 123.84 40.7 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.124 0.487 . . . . 10.0 111.808 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -80.53 125.25 29.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 10.0 110.496 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -147.71 -169.45 3.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.09 -0.505 . . . . 10.0 110.119 179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.692 ' HE2' ' H2 ' ' B' ' 202' ' ' PCW . 5.0 tmtm? 71.7 91.06 0.09 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 121.364 0.602 . . . . 10.0 111.377 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -141.76 23.89 2.07 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.628 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 94.9 6.17 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.975 -0.557 . . . . 10.0 111.872 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 35.2 tttt -146.74 90.06 1.88 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.046 0.451 . . . . 10.0 110.856 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' THR . . . . . . . . . . . . . 4.4 t -102.4 131.71 48.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.467 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' LYS . . . . . 0.412 ' HE2' H151 ' A' ' 402' ' ' PCW . 36.3 tttm -169.25 -38.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.603 -0.271 . . . . 10.0 111.198 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 C--O 1.239 0.51 0 CA-C-N 116.137 -0.483 . . . . 10.0 111.812 179.899 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 356' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.56 0.695 . . . . 10.0 110.264 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 357' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.79 138.29 34.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.531 -0.758 . . . . 10.0 111.986 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 358' ' ' ILE . . . . . 0.516 ' O ' HG13 ' D' ' 369' ' ' VAL . 3.6 tp -143.98 121.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.047 179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 359' ' ' ARG . . . . . 0.659 ' HA ' HG22 ' D' ' 369' ' ' VAL . 15.0 mtt180 -90.83 102.16 14.92 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.222 0.453 . . . . 10.0 112.222 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 360' ' ' VAL . . . . . . . . . . . . . 40.7 t -91.97 112.79 26.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 109.374 -0.602 . . . . 10.0 109.374 178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 361' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' D' ' 425' ' ' GLU . 30.3 m-85 -95.78 118.51 32.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.652 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 362' ' ' LEU . . . . . . . . . . . . . 63.2 mt -89.25 162.7 36.52 Favored Pre-proline 0 C--N 1.32 -0.691 0 CA-C-N 115.371 -0.831 . . . . 10.0 109.49 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 363' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -52.4 156.47 8.21 Favored 'Trans proline' 0 C--O 1.239 0.549 0 C-N-CA 122.727 2.285 . . . . 10.0 113.628 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 364' ' ' ASN . . . . . . . . . . . . . 38.4 t30 71.07 -87.81 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.039 -0.982 . . . . 10.0 112.926 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 365' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -158.15 17.08 0.23 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 112.479 0.548 . . . . 10.0 112.479 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 366' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -92.9 151.19 20.09 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.874 -0.331 . . . . 10.0 110.611 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 367' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -142.7 149.85 39.37 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.669 -0.241 . . . . 10.0 110.804 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 368' ' ' THR . . . . . . . . . . . . . 27.3 m -152.78 98.92 2.39 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.698 0.624 . . . . 10.0 110.568 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 369' ' ' VAL . . . . . 0.802 ' CG2' ' HB3' ' B' ' 37' ' ' GLU . 53.1 t -77.88 112.47 15.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.405 -0.591 . . . . 10.0 109.405 179.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 370' ' ' VAL . . . . . . . . . . . . . 26.9 m -88.98 179.49 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.557 0.536 . . . . 10.0 111.247 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 371' ' ' ASN . . . . . 0.53 ' HB2' HD11 ' B' ' 36' ' ' ILE . 35.8 t-20 -121.41 99.49 6.5 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 10.0 110.703 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 372' ' ' VAL . . . . . . . . . . . . . 18.6 m -86.31 153.45 3.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.87 -0.604 . . . . 10.0 110.776 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 373' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' D' ' 373' ' ' ARG . 2.0 tpp85 -163.84 159.1 20.75 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.828 -0.434 . . . . 10.0 109.828 -179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 374' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 62.39 -104.09 0.14 Allowed 'General case' 0 C--O 1.236 0.349 0 O-C-N 123.641 0.588 . . . . 10.0 111.679 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 375' ' ' GLY . . . . . . . . . . . . . . . -138.98 106.22 0.5 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.336 -0.706 . . . . 10.0 111.336 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 376' ' ' MET . . . . . . . . . . . . . 60.5 mtt -141.91 143.57 33.36 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.716 0.294 . . . . 10.0 110.611 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 377' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.33 173.91 6.11 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.893 -0.78 . . . . 10.0 108.893 178.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 378' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 426' ' ' LEU . 22.2 mt -58.16 -42.71 86.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.066 0.46 . . . . 10.0 110.255 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 379' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -56.46 -37.75 70.74 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.349 -0.841 . . . . 10.0 111.92 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 380' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -67.49 -51.36 52.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 10.0 111.871 -178.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 381' ' ' CYS . . . . . . . . . . . . . 3.9 m -65.42 -39.95 92.75 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.143 -0.481 . . . . 10.0 111.865 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 382' ' ' LEU . . . . . . . . . . . . . 90.5 mt -68.31 -18.36 64.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.278 -0.419 . . . . 10.0 112.049 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 383' ' ' MET . . . . . . . . . . . . . 21.8 tpp -69.21 -38.7 78.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.833 0.349 . . . . 10.0 110.374 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 384' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' D' ' 387' ' ' LYS . 91.2 mttt -69.44 -43.11 74.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.499 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 385' ' ' ALA . . . . . . . . . . . . . . . -67.58 -24.84 65.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.961 -0.563 . . . . 10.0 111.945 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 386' ' ' LEU . . . . . . . . . . . . . 22.4 tp -78.55 -33.57 47.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.896 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 387' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' D' ' 384' ' ' LYS . 20.2 ptmt -64.48 -33.47 75.96 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.733 1.012 . . . . 10.0 113.733 -178.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 388' ' ' VAL . . . . . 0.656 ' HB ' HG21 ' B' ' 21' ' ' ILE . 1.6 m -89.33 16.15 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.936 0.398 . . . . 10.0 111.043 179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 389' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' D' ' 389' ' ' ARG . 12.3 mmt85 -127.52 -47.09 1.44 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 10.0 110.728 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 390' ' ' GLY . . . . . . . . . . . . . . . 78.7 44.68 10.2 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.939 -0.648 . . . . 10.0 111.58 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 391' ' ' LEU . . . . . . . . . . . . . 96.2 mt -106.5 175.43 5.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.807 0.337 . . . . 10.0 110.798 -179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 392' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -102.58 122.36 46.48 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.066 -0.516 . . . . 10.0 111.128 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 393' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.3 -11.21 24.74 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.719 2.28 . . . . 10.0 111.696 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 394' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -63.62 -32.71 74.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.495 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 395' ' ' CYS . . . . . 0.464 ' O ' ' HA ' ' D' ' 430' ' ' PHE . 29.0 m -103.41 12.85 34.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.076 -0.511 . . . . 10.0 111.862 -179.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 396' ' ' CYS . . . . . . . . . . . . . 79.4 m -106.12 133.75 50.33 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.616 0.246 . . . . 10.0 110.937 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 397' ' ' ALA . . . . . . . . . . . . . . . -125.46 141.5 52.02 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.692 -0.484 . . . . 10.0 109.692 179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 398' ' ' VAL . . . . . . . . . . . . . 3.7 m -95.21 119.6 43.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-O 121.445 0.64 . . . . 10.0 111.812 -179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 399' ' ' PHE . . . . . 0.709 ' HE2' ' HB3' ' D' ' 429' ' ' ASP . 60.4 m-85 -115.9 126.67 54.22 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.617 -0.72 . . . . 10.0 109.915 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 400' ' ' ARG . . . . . 0.465 ' HG2' ' HB3' ' D' ' 410' ' ' ALA . 9.2 ptm180 -80.49 -177.42 6.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.689 0.281 . . . . 10.0 111.016 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 401' ' ' LEU . . . . . . . . . . . . . 44.1 tp -69.08 133.32 47.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.258 -0.428 . . . . 10.0 109.963 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 402' ' ' LEU . . . . . . . . . . . . . 9.8 mp -66.48 101.31 0.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.249 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 403' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -101.46 102.33 13.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.102 -0.499 . . . . 10.0 111.356 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 404' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 54.15 63.19 2.26 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.331 -0.849 . . . . 10.0 111.933 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 405' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -121.83 161.69 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.906 -0.588 . . . . 10.0 111.114 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 406' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -73.06 -24.0 60.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.159 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 407' ' ' GLY . . . . . . . . . . . . . . . 137.06 49.95 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.818 -0.706 . . . . 10.0 112.095 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 408' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -135.48 141.27 45.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.928 -0.397 . . . . 10.0 109.928 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 409' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -65.44 128.05 34.31 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.14 -0.482 . . . . 10.0 110.165 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 410' ' ' ALA . . . . . 0.465 ' HB3' ' HG2' ' D' ' 400' ' ' ARG . . . -84.51 97.79 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.032 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 411' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' D' ' 411' ' ' ARG . 42.8 ttp-105 -72.57 125.57 27.76 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.961 -0.563 . . . . 10.0 112.385 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 412' ' ' LEU . . . . . . . . . . . . . 13.5 mt -112.88 -171.99 1.97 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.056 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 413' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.46 156.83 17.06 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 414' ' ' TRP . . . . . . . . . . . . . 36.2 m95 -73.67 -24.24 59.94 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.692 0.256 . . . . 10.0 111.692 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 415' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -80.65 -1.02 40.64 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 112.385 0.513 . . . . 10.0 112.385 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 416' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' D' ' 378' ' ' LEU . 11.9 m -60.22 135.45 57.73 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 109.633 -0.506 . . . . 10.0 109.633 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 417' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -74.87 150.33 39.23 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.987 0.422 . . . . 10.0 111.278 -178.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 418' ' ' ALA . . . . . . . . . . . . . . . -81.43 -28.84 34.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.883 -0.599 . . . . 10.0 111.644 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.07 -28.38 68.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 10.0 111.494 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 420' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.62 8.25 26.15 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.188 0.518 . . . . 10.0 110.505 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 421' ' ' LEU . . . . . . . . . . . . . 3.3 tp -125.95 19.64 7.74 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.019 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 422' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.99 126.92 21.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-N 115.773 -0.648 . . . . 10.0 111.96 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 423' ' ' GLY . . . . . . . . . . . . . . . 82.27 2.66 90.64 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.705 -0.679 . . . . 10.0 113.234 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 424' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -100.08 169.0 9.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.167 0.508 . . . . 10.0 111.156 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 425' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' D' ' 361' ' ' PHE . 34.6 mt-10 -116.38 112.61 21.73 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.648 -0.705 . . . . 10.0 110.072 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 426' ' ' LEU . . . . . 0.451 HD22 HD22 ' D' ' 378' ' ' LEU . 22.2 tp -99.8 131.92 45.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.72 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 427' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -116.25 131.81 56.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.916 0.388 . . . . 10.0 111.709 -179.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 428' ' ' VAL . . . . . . . . . . . . . 16.3 t -104.75 114.5 44.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.065 -0.717 . . . . 10.0 109.065 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 429' ' ' ASP . . . . . 0.709 ' HB3' ' HE2' ' D' ' 399' ' ' PHE . 13.5 t0 -122.07 161.24 23.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.534 -0.303 . . . . 10.0 110.678 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 430' ' ' PHE . . . . . 0.464 ' HA ' ' O ' ' D' ' 395' ' ' CYS . 52.5 m-85 -88.74 150.35 23.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.354 -0.385 . . . . 10.0 111.114 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 431' ' ' LEU . . . . . . . . . . . . . 1.6 pp -92.2 -164.49 1.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.95 0.405 . . . . 10.0 111.928 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 432' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -79.27 82.16 5.45 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.062 -0.517 . . . . 10.0 111.226 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 433' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -136.09 44.15 2.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.52 . . . . 10.0 109.636 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 434' ' ' VAL . . . . . . . . . . . . . 21.6 t 64.66 76.99 0.3 Allowed Pre-proline 0 CA--C 1.531 0.214 0 CA-C-N 115.239 -0.891 . . . . 10.0 110.688 -179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 435' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -92.88 -163.39 0.11 Allowed 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.664 2.243 . . . . 10.0 112.056 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 436' ' ' LEU . . . . . . . . . . . . . 2.2 tm? 75.22 110.14 0.07 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.366 0.666 . . . . 10.0 112.103 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 437' ' ' THR . . . . . 0.525 ' HB ' HG21 ' D' ' 467' ' ' THR . 0.0 OUTLIER -98.0 131.59 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 10.0 110.009 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 438' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.34 -165.23 0.98 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.667 0.617 . . . . 10.0 112.667 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 439' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -88.02 142.0 28.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.377 -0.828 . . . . 10.0 110.266 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 440' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' D' ' 465' ' ' CYS . 23.1 t-20 -117.17 146.64 43.08 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.149 -0.315 . . . . 10.0 110.149 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 441' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -105.21 91.92 3.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.844 0.354 . . . . 10.0 111.663 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 442' ' ' ALA . . . . . . . . . . . . . . . -99.2 126.61 45.03 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.699 -0.482 . . . . 10.0 109.699 178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 443' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' D' ' 443' ' ' ARG . 2.1 ptm180 -101.77 112.09 24.57 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.225 0.536 . . . . 10.0 111.269 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.21 159.81 4.93 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.706 -0.679 . . . . 10.0 111.165 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 445' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.57 172.28 11.65 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 115.835 -0.621 . . . . 10.0 110.155 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 446' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' D' ' 471' ' ' LYS . 92.0 m-85 -109.4 175.25 5.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.523 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 447' ' ' LEU . . . . . . . . . . . . . 65.8 mt -96.7 -64.26 1.06 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.701 -0.481 . . . . 10.0 109.701 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 448' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -101.58 169.34 8.9 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.8 -0.636 . . . . 10.0 109.939 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 449' ' ' LEU . . . . . . . . . . . . . 9.1 mp -75.48 137.92 41.25 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.347 -0.388 . . . . 10.0 111.806 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 450' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' D' ' 471' ' ' LYS . . . -149.9 116.29 5.77 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.862 -0.792 . . . . 10.0 108.862 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 451' ' ' PHE . . . . . 0.562 ' CE1' ' H63' ' D' ' 501' ' ' PCW . 15.5 m-85 -69.25 155.43 40.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.773 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 452' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.85 158.45 22.01 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.968 0.413 . . . . 10.0 111.016 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 453' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.58 -14.28 23.69 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.954 -0.566 . . . . 10.0 109.591 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 454' ' ' ILE . . . . . . . . . . . . . 43.6 mm -105.37 -52.67 7.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.5 -0.773 . . . . 10.0 110.531 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 455' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.69 -164.49 1.1 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.801 0.334 . . . . 10.0 110.463 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 456' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -121.44 17.68 11.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.305 0.574 . . . . 10.0 109.785 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 457' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -92.48 156.58 17.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.402 -0.817 . . . . 10.0 110.886 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 458' ' ' PHE . . . . . . . . . . . . . 24.6 p90 -77.89 154.43 31.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.233 -0.439 . . . . 10.0 111.645 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 459' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -91.43 142.76 27.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.351 -0.386 . . . . 10.0 110.223 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 460' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' D' ' 461' ' ' ASN . 0.2 OUTLIER -126.41 -86.49 0.6 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 10.0 111.197 179.58 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 461' ' ' ASN . . . . . 0.432 HD22 ' C3 ' ' B' ' 213' ' ' 17F . 19.5 p30 -129.04 50.47 2.13 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.096 0.474 . . . . 10.0 110.67 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 462' ' ' GLY . . . . . . . . . . . . . . . -86.16 -132.9 3.19 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.547 -0.751 . . . . 10.0 112.298 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 463' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -127.79 151.5 48.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.174 0.511 . . . . 10.0 111.922 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 464' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -145.29 150.95 37.56 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.449 -0.945 . . . . 10.0 108.449 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 465' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' D' ' 440' ' ' ASN . 0.0 OUTLIER -86.33 176.28 7.99 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.846 0.684 . . . . 10.0 112.846 -179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -115.35 -42.12 3.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.45 -0.795 . . . . 10.0 110.063 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 467' ' ' THR . . . . . 0.525 HG21 ' HB ' ' D' ' 437' ' ' THR . 2.7 m -77.38 -50.76 12.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.99 -0.55 . . . . 10.0 109.692 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 468' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.3 -76.63 0.17 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.752 -0.658 . . . . 10.0 109.825 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 469' ' ' GLY . . . . . . . . . . . . . . . 111.11 47.99 0.74 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.612 -0.804 . . . . 10.0 112.65 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 470' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.4 172.16 6.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.949 -0.389 . . . . 10.0 109.949 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 471' ' ' LYS . . . . . 0.66 ' HE2' ' HB1' ' D' ' 450' ' ' ALA . 0.0 OUTLIER -133.4 134.11 43.25 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.693 0.282 . . . . 10.0 110.771 179.431 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' D' D ' 472' ' ' PHE . . . . . 0.692 ' HB2' ' HB2' ' D' ' 476' ' ' CYS . 31.6 p90 -152.49 165.59 34.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.638 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 473' ' ' HIS . . . . . 0.5 ' HB2' ' SG ' ' D' ' 476' ' ' CYS . 67.9 m80 -88.36 175.32 7.69 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.35 -0.386 . . . . 10.0 111.066 -179.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 474' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -65.82 -22.08 66.53 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.248 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 475' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -100.33 -8.15 23.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.312 -0.403 . . . . 10.0 111.153 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 476' ' ' CYS . . . . . 0.692 ' HB2' ' HB2' ' D' ' 472' ' ' PHE . 63.7 m -85.88 -22.97 27.25 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.63 -0.259 . . . . 10.0 111.034 -179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -44.28 70.44 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.121 -0.49 . . . . 10.0 112.029 -178.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 478' ' ' THR . . . . . . . . . . . . . 1.2 m -101.65 13.34 35.21 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.162 0.506 . . . . 10.0 110.794 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -104.94 -32.21 8.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.095 -0.502 . . . . 10.0 111.748 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 480' ' ' VAL . . . . . 0.418 HG12 ' O ' ' D' ' 476' ' ' CYS . 4.1 p -92.68 107.19 22.38 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.033 0.444 . . . . 10.0 110.817 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.45 -16.0 15.4 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.271 1.981 . . . . 10.0 111.426 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 482' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -81.44 91.01 6.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.875 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' D' D ' 483' ' ' MET . . . . . . . . . . . . . 52.6 tpp -62.47 159.06 16.33 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.526 -0.761 . . . . 10.0 111.32 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 484' ' ' CYS . . . . . . . . . . . . . 58.6 m -74.08 70.06 1.53 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.259 179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 485' ' ' VAL . . . . . . . . . . . . . 7.2 t -105.96 112.69 40.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.245 179.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 486' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -122.06 137.06 54.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.214 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 487' ' ' TRP . . . . . . . . . . . . . 42.2 p90 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.288 -0.415 . . . . 10.0 110.37 179.461 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' PCW . . . . . 1.11 H182 H221 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' PCW . . . . . 0.9 H342 H212 ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' PCW . . . . . 1.001 ' H82' H351 ' B' ' 209' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' PCW . . . . . 0.975 ' H41' ' H32' ' A' ' 407' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' PCW . . . . . 1.171 ' C19' H142 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' PCW . . . . . 0.783 H452 H471 ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' PCW . . . . . 1.04 ' H82' ' H2 ' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' PCW . . . . . 1.079 H122 ' H71' ' A' ' 409' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' 17F . . . . . 1.079 ' H71' H122 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' 17F . . . . . 0.908 ' H78' H482 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' PCW . . . . . 1.061 H161 H331 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' PCW . . . . . 0.98 H431 H471 ' C' ' 623' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' PCW . . . . . 1.066 H422 ' C23' ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' PCW . . . . . 0.871 H272 H482 ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' PCW . . . . . 1.1 H372 ' C43' ' C' ' 616' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' PCW . . . . . 1.01 H162 ' H57' ' C' ' 630' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' PCW . . . . . 1.064 H141 H382 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 601' ' ' PCW . . . . . 1.013 H472 H432 ' C' ' 601' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 602' ' ' PCW . . . . . 0.866 H172 H221 ' C' ' 602' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 603' ' ' PCW . . . . . 1.067 H371 H412 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 604' ' ' PCW . . . . . 0.966 H482 H282 ' C' ' 624' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 605' ' ' PCW . . . . . 0.978 ' O31' ' H51' ' C' ' 612' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 606' ' ' PCW . . . . . 1.114 H212 H172 ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 607' ' ' PCW . . . . . 1.074 H431 ' C1Z' ' C' ' 626' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 608' ' ' PCW . . . . . 0.948 H281 ' H52' ' B' ' 214' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 609' ' ' PCW . . . . . 1.041 ' H63' ' H6A' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 610' ' ' PCW . . . . . 0.966 H452 H481 ' C' ' 618' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 611' ' ' PCW . . . . . 1.067 H232 H471 ' C' ' 611' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 612' ' ' PCW . . . . . 1.03 H251 ' H47' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 613' ' ' PCW . . . . . 0.966 H421 ' C46' ' C' ' 613' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 614' ' ' PCW . . . . . 0.911 H211 ' H41' ' C' ' 632' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 615' ' ' PCW . . . . . 1.026 ' H31' ' O4P' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 616' ' ' PCW . . . . . 1.1 ' C43' H372 ' A' ' 415' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 617' ' ' PCW . . . . . 0.942 H142 ' H39' ' C' ' 615' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 618' ' ' PCW . . . . . 0.966 H481 H452 ' C' ' 610' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 619' ' ' PCW . . . . . 1.081 ' O1P' ' H52' ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 620' ' ' PCW . . . . . 1.081 ' H52' ' O1P' ' C' ' 619' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 621' ' ' PCW . . . . . 1.055 H122 ' H67' ' C' ' 627' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 622' ' ' PCW . . . . . 1.055 ' C36' H322 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 623' ' ' PCW . . . . . 1.036 H261 H421 ' C' ' 622' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 624' ' ' PCW . . . . . 1.057 ' H19' ' H73' ' C' ' 606' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 625' ' ' PCW . . . . . 1.0 H281 ' H51' ' C' ' 631' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 626' ' ' 17F . . . . . 1.074 ' C1Z' H431 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 627' ' ' 17F . . . . . 1.055 ' H67' H122 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 628' ' ' 17F . . . . . 0.953 ' H4A' ' C8 ' ' C' ' 604' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 629' ' ' 17F . . . . . 0.833 ' H62' H261 ' C' ' 607' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 630' ' ' 17F . . . . . 1.01 ' H57' H162 ' A' ' 416' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 631' ' ' 17F . . . . . 1.041 ' H6A' ' H63' ' C' ' 609' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 632' ' ' 17F . . . . . 1.05 ' H77' H412 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' PCW . . . . . 1.0 H121 H132 ' A' ' 403' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' PCW . . . . . 1.083 ' C4 ' ' H31' ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' PCW . . . . . 1.058 H341 ' C32' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' PCW . . . . . 1.029 H131 H151 ' B' ' 208' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' PCW . . . . . 1.12 H332 H121 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' PCW . . . . . 1.077 H332 H331 ' D' ' 505' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' PCW . . . . . 1.292 H251 ' C20' ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' PCW . . . . . 1.029 H151 H131 ' B' ' 204' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' PCW . . . . . 1.056 H121 H351 ' B' ' 207' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' PCW . . . . . 0.929 ' H11' H131 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' PCW . . . . . 1.073 H352 ' O31' ' B' ' 211' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' PCW . . . . . 1.04 H422 ' H59' ' D' ' 514' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' 17F . . . . . 1.043 H20A H142 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' 17F . . . . . 0.989 ' H32' H283 ' B' ' 203' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' 17F . . . . . 1.076 ' H6 ' H141 ' C' ' 620' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' GNP . . . . . 0.613 ' O1G' ' HB3' ' B' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 501' ' ' PCW . . . . . 1.022 H161 ' H18' ' D' ' 511' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 502' ' ' PCW . . . . . 1.022 H231 H381 ' A' ' 401' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 503' ' ' PCW . . . . . 1.079 H152 ' H39' ' D' ' 507' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 504' ' ' PCW . . . . . 0.896 ' H31' H161 ' B' ' 202' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 505' ' ' PCW . . . . . 1.077 H331 H332 ' B' ' 206' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 506' ' ' PCW . . . . . 1.028 H272 H421 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 507' ' ' PCW . . . . . 1.079 ' H39' H152 ' D' ' 503' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 508' ' ' PCW . . . . . 1.252 H222 ' C27' ' D' ' 508' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 509' ' ' PCW . . . . . 1.057 ' H61' H321 ' D' ' 510' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 510' ' ' PCW . . . . . 1.057 H321 ' H61' ' D' ' 509' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 511' ' ' 17F . . . . . 1.032 H12A H471 ' A' ' 408' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 512' ' ' 17F . . . . . 1.01 ' H31' ' H2 ' ' A' ' 405' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 513' ' ' 17F . . . . . 1.074 ' H11' ' H65' ' D' ' 513' ' ' 17F . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 514' ' ' 17F . . . . . 1.04 ' H59' H422 ' B' ' 212' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 515' ' ' PCW . . . . . 1.031 H212 H271 ' C' ' 603' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 516' ' ' PCW . . . . . 0.996 H442 H341 ' C' ' 621' ' ' PCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 517' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 518' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_